SCHEMBL19783083

SCHEMBL19783083

COc1c(F)cc(F)c2nc(Cl)sc12

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
ILK Q13418 1/20 0.36
PDGFRB P09619 1/20 0.31
PDGFRA P16234 1/20 0.31

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
SCHEMBL30189678 1.00 ALDH1A1 (0.49) ALDH1A1ILKPDGFRBPDGFRA
SCHEMBL30189744 0.81 ALDH1A1 (0.42) ALDH1A1ILKPDGFRBPDGFRA
SCHEMBL19783248 0.81 ALDH1A1 (0.42) ALDH1A1ILKPDGFRBPDGFRA
SCHEMBL20597620 0.75 ALDH1A1 (0.74) ALDH1A1ILK
SCHEMBL6514749 0.72 ALDH1A1 (0.47) ALDH1A1
SCHEMBL19775976 0.71 ILK (0.40) ALDH1A1ILKPDGFRBPDGFRA
SCHEMBL21468916 0.70 ALDH1A1 (0.45) ALDH1A1
SCHEMBL29872373 0.69 ALDH1A1 (0.46) ALDH1A1PDGFRA
SCHEMBL19776248 0.68 ALDH1A1 (0.50) ALDH1A1
SCHEMBL19776328 0.68 ALDH1A1 (0.50) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BISTOL MYERS SQUIBB COMPANY (US) 2019-09-26 US disclosed
WO-2018013774-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 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-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, PF4 ALDH1A1 1618/4885ILK 2829/4885PDGFRB 494/4885
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, F12 ALDH1A1 1598/4885ILK 2999/4885PDGFRB 368/4885

“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.