SCHEMBL21628563

SCHEMBL21628563

CCC(CC)c1ccc(Oc2ccc(C(=O)O)cc2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
TTR P02766 2/20 0.45
LPAR1 Q92633 7/20 0.45
LPAR5 Q9H1C0 7/20 0.45
S1PR2 O95136 1/20 0.44
PTGER4 P35408 2/20 0.43
PTGER2 P43116 1/20 0.43
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
IGFBP3 P17936 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42
CASP1 P29466 1/20 0.42

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
SCHEMBL21628595 0.88 PARP10 (0.51) MAPK1HDAC8HDAC6
SCHEMBL21628887 0.87 USP2 (0.44) LMNAMAPK1HTTRAB9AHDAC8
SCHEMBL21628545 0.86 CA12 (0.43) LMNAMAPK1HDAC8HDAC6
SCHEMBL21628568 0.86 SLC6A2 (0.47) HTTS1PR2PTGER4PTGER2HDAC8
SCHEMBL21628816 0.86 HDAC6 (0.59) HDAC8HDAC6
SCHEMBL21656770 0.86 SLC6A2 (0.49) LPAR1LPAR5S1PR2HDAC8HDAC6
SCHEMBL21628711 0.85 LMNA (0.56) LMNAMAPK1HTTRAB9ATTR
SCHEMBL21628551 0.82 LMNA (0.56) LMNAMAPK1HTTRAB9ATTR
SCHEMBL21656832 0.81 SRD5A2 (0.58) MAPK1RAB9AHDAC8HDAC6
SCHEMBL21274603 0.80 LMNA (0.60) LMNAMAPK1HTTRAB9ATTR

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12600696-B2 Aromatic compounds Xeniopro GmbH (DE) 2026-04-14 US disclosed
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-05-18 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2022-11-03 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 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 (7 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-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK LMNA 3327/4885MAPK1 3508/4885HTT 550/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK LMNA 3327/4885MAPK1 3508/4885HTT 550/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK LMNA 3083/4885MAPK1 3401/4885HTT 304/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK LMNA 3327/4885MAPK1 3508/4885HTT 550/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR LMNA 832/4885MAPK1 2406/4885HTT 703/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK LMNA 3327/4885MAPK1 3508/4885HTT 550/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK LMNA 3327/4885MAPK1 3508/4885HTT 550/4885

“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.