SCHEMBL21097265

SCHEMBL21097265

CC(C)Oc1cnc(C(C)C)nc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.34
FGFR1 P11362 1/20 0.34
KMT2A Q03164 1/20 0.33
SYK P43405 1/20 0.33
BRD4 O60885 1/20 0.32
BRPF1 P55201 1/20 0.32
PARP10 Q53GL7 1/20 0.32
ACACB O00763 4/20 0.32
MAP4K4 O95819 1/20 0.32
ALDH1A1 P00352 1/20 0.31
APLNR P35414 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TBK1 Q9UHD2 1/20 0.31
POLB P06746 1/20 0.31
DHFR P00374 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22428387 0.82 RXRA (0.33)
SCHEMBL23105268 0.79 ALDH1A1 (0.35) ALDH1A3ACACBALDH1A1SMN1; SMN2POLB
SCHEMBL12896071 0.78 ALDH1A3 (0.35) ALDH1A3FGFR1KMT2ASYKPARP10
SCHEMBL12191929 0.78 APLNR (0.37) ALDH1A1APLNR
SCHEMBL18484467 0.76 KMT2A (0.38) ALDH1A3KMT2ASYKPARP10ACACB
SCHEMBL19493806 0.76 ALDH1A3 (0.34) ALDH1A3FGFR1KMT2ASYKPARP10
SCHEMBL22504198 0.76 APLNR (0.31) APLNR
SCHEMBL24326416 0.76 ALDH1A3 (0.34) ALDH1A3KMT2ASYKPARP10ACACB
SCHEMBL9369865 0.76 TP53 (0.46) ALDH1A3KMT2ASYKPARP10MAP4K4
SCHEMBL355299 0.76 MAP4K4 (0.38) ALDH1A3KMT2ASYKMAP4K4ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773091-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2023-10-03 US disclosed
US-11773091-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2023-10-03 US disclosed
EP-3728216-B1 PYRAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2023-09-06 EP disclosed
US-11697646-B2 Triazole N-linked carbamoyl cyclohexyl acids as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2023-07-11 US disclosed
US-11697646-B2 Triazole N-linked carbamoyl cyclohexyl acids as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2023-07-11 US disclosed
EP-3728242-B1 CYCLOHEXYL ACID ISOXAZOLE AZOLES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2023-03-01 EP disclosed
US-11384079-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2022-07-12 US disclosed
EP-3727589-B1 CYCLOHEXYL ACID PYRAZOLE AZOLES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2022-06-29 EP disclosed
US-11352345-B2 Cyclohexyl acid pyrazole azoles as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2022-06-07 US disclosed
US-11319309-B2 Cyclohexyl acid isoxazole azines as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2022-05-03 US disclosed
US-20210230143-A1 CYCLOHEXYL ACID TRIAZOLE AZINES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2021-07-29 US disclosed
US-20210087178-A1 CYCLOHEXYL ACID PYRAZOLE AZINES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2021-03-25 US disclosed
US-20210078982-A1 CYCLOHEXYL ACID PYRAZOLE AZOLES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2021-03-18 US disclosed
US-20200347049-A1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX, INC. 2020-11-05 US disclosed
US-20200317662-A1 CYCLOHEXYL ACID ISOXAZOLE AZOLES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2020-10-08 US disclosed
US-20200317655-A1 ISOXAZOLE O-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2020-10-08 US disclosed
US-20200308148-A1 PYRAZOLE O-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2020-10-01 US disclosed
US-10662172-B2 Triazole N-linked carbamoyl cyclohexyl acids as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2020-05-26 US disclosed
US-10562896-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2020-02-18 US disclosed
US-20190185446-A1 TRIAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY 2019-06-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200347049-A1 6-5 FUSED RINGS AS C5a INHIBITORS C5AR1, C5AR2, C3AR1 ALDH1A3 3643/4885FGFR1 3438/4885KMT2A 4819/4885
US-20210078982-A1 CYCLOHEXYL ACID PYRAZOLE AZOLES AS LPA ANTAGONISTS LPAR1, LPAR3, LPAR2 ALDH1A3 2078/4885FGFR1 84/4885KMT2A 2722/4885
US-11319309-B2 Cyclohexyl acid isoxazole azines as LPA antagonists LPAR1, LPAR2, LPAR5 ALDH1A3 2110/4885FGFR1 195/4885KMT2A 3197/4885
US-20210230143-A1 CYCLOHEXYL ACID TRIAZOLE AZINES AS LPA ANTAGONISTS LPAR3, LPAR1, LPAR2 ALDH1A3 2228/4885FGFR1 93/4885KMT2A 1913/4885
US-11773091-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 ALDH1A3 3643/4885FGFR1 3438/4885KMT2A 4819/4885
US-11384079-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 ALDH1A3 3643/4885FGFR1 3438/4885KMT2A 4819/4885
US-20190185446-A1 TRIAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS LPAR3, LPAR1, LPAR2 ALDH1A3 2794/4885FGFR1 103/4885KMT2A 1795/4885
US-20210087178-A1 CYCLOHEXYL ACID PYRAZOLE AZINES AS LPA ANTAGONISTS LPAR3, LPAR1, LPAR2 ALDH1A3 2329/4885FGFR1 78/4885KMT2A 2889/4885
US-10662172-B2 Triazole N-linked carbamoyl cyclohexyl acids as LPA antagonists LPAR3, LPAR1, LPAR2 ALDH1A3 2794/4885FGFR1 103/4885KMT2A 1795/4885
US-20200308148-A1 PYRAZOLE O-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS LPAR3, LPAR1, LPAR2 ALDH1A3 2714/4885FGFR1 89/4885KMT2A 2297/4885
US-20200317662-A1 CYCLOHEXYL ACID ISOXAZOLE AZOLES AS LPA ANTAGONISTS LPAR1, LPAR2, LPAR3 ALDH1A3 1751/4885FGFR1 241/4885KMT2A 2720/4885
US-10562896-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 ALDH1A3 3643/4885FGFR1 3438/4885KMT2A 4819/4885
US-11697646-B2 Triazole N-linked carbamoyl cyclohexyl acids as LPA antagonists LPAR3, LPAR1, LPAR2 ALDH1A3 2794/4885FGFR1 103/4885KMT2A 1795/4885
US-20200317655-A1 ISOXAZOLE O-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS LPAR3, LPAR4, LPAR6 ALDH1A3 1917/4885FGFR1 1214/4885KMT2A 3510/4885
US-11352345-B2 Cyclohexyl acid pyrazole azoles as LPA antagonists LPAR1, LPAR3, LPAR2 ALDH1A3 2078/4885FGFR1 84/4885KMT2A 2722/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.