SCHEMBL26906871

SCHEMBL26906871

COc1nc(N2CCC(N(C)C)C2)ccc1Nc1ncc(Cl)c(Nc2ccc3nccnc3c2P(C)C)n1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.50
▸ ALK Q9UM73 13/20 0.49
▸ INSR P06213 2/20 0.49
▸ IGF1R P08069 2/20 0.49
▸ ROS1 P08922 6/20 0.47
▸ ZAP70 P43403 1/20 0.46
▸ AURKA O14965 1/20 0.45
▸ EML4 Q9HC35 1/20 0.45

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
SCHEMBL26906651 0.87 EGFR (0.66) EGFRALKINSRIGF1RROS1
SCHEMBL29904679 0.87 EGFR (0.66) EGFRALKINSRIGF1RROS1
SCHEMBL30659720 0.85 ALK (0.53) EGFRALKINSRROS1
SCHEMBL28530455 0.79 EGFR (0.79) EGFRALKINSRIGF1R
SCHEMBL28536447 0.78 EGFR (0.69) EGFR
SCHEMBL29904717 0.77 ALK (0.46) EGFRALKINSRIGF1RROS1
SCHEMBL26906810 0.77 ZAP70 (0.66) EGFRALKINSRIGF1RROS1
SCHEMBL29904620 0.77 ZAP70 (0.66) EGFRALKINSRIGF1RROS1
SCHEMBL28908537 0.77 EGFR (0.81) EGFR
SCHEMBL22595142 0.77 EGFR (0.61) EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4286376-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME Therapex Co., Ltd. (KR) 2023-12-06 — — EP disclosed
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