SCHEMBL21801345

SCHEMBL21801345

CCOC(=O)CCc1cc2c(Cl)ncnc2n1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 2/20 0.35
KAT2B Q92831 1/20 0.34
TNF P01375 3/20 0.34
CYP4F2 P78329 2/20 0.34
CYP4A11 Q02928 2/20 0.34
EGFR P00533 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
KDM4E B2RXH2 2/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL21801364 0.85 DAPK1 (0.39) L3MBTL1MAPTLMNAKDM4ETP53
SCHEMBL21179013 0.79 ATM (0.40) MAPTLMNAKDM4EPOLBHSD17B10
SCHEMBL21178852 0.76 SELE (0.33) EGFRALDH1A1
SCHEMBL21801405 0.76 L3MBTL1 (0.35) L3MBTL1MAPTHPGDLMNAKAT2B
SCHEMBL29456324 0.74 PDE4B (0.42) MAPTALDH1A1
SCHEMBL23885609 0.71 RAB9A (0.45) L3MBTL1MAPTHPGDKDM4EHSD17B10
SCHEMBL3401964 0.69 TNF (0.45) MAPTHPGDLMNAKAT2BTNF
SCHEMBL12590776 0.68 CYP1A2 (0.44) L3MBTL1KAT2BTNFCYP4F2CYP4A11
SCHEMBL28674155 0.67 JAK2 (0.44) MAPTLMNAKDM4EPOLBMAPK1
SCHEMBL12844463 0.66 L3MBTL1 (0.45) L3MBTL1MAPTHPGDLMNACYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11964988-B2 Fused heterocyclic compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2024-04-23 US disclosed
EP-3849986-B1 FUSED HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2022-06-08 EP disclosed
US-20220112214-A1 FUSED HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2022-04-14 US disclosed
EP-3849986-A1 FUSED HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS Array Biopharma, Inc. (US) 2021-07-21 EP disclosed
WO-2020055672-A1 FUSED HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2020-03-19 WO 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 (2 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-20220112214-A1 FUSED HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, FRK L3MBTL1 1737/4885MAPT 318/4885HPGD 3693/4885
US-11964988-B2 Fused heterocyclic compounds as RET kinase inhibitors RET, ROR1, FRK L3MBTL1 1737/4885MAPT 318/4885HPGD 3693/4885

“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.