SCHEMBL5313559

SCHEMBL5313559

Nc1nccc2c1ccn2-c1ccc(NC(=O)CC(=O)Nc2ccc(F)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ THRB P10828 1/20 0.44
▸ MET P08581 9/20 0.43
▸ MAPT P10636 2/20 0.42
▸ GFER P55789 1/20 0.41
▸ AXL P30530 2/20 0.40
▸ MST1R Q04912 2/20 0.40
▸ TYRO3 Q06418 2/20 0.40
▸ CSF1R P07333 1/20 0.40
▸ PLK4 O00444 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ NTRK1 P04629 1/20 0.40
▸ LCK P06239 1/20 0.40
▸ RET P07949 1/20 0.40
▸ KIT P10721 1/20 0.40
▸ PDGFRA P16234 1/20 0.40
▸ PRKACA P17612 1/20 0.40
▸ KDR P35968 1/20 0.40

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
SCHEMBL3883270 0.86 MET (0.49) TP53THRBMETCSF1RPDGFRA
SCHEMBL3882961 0.85 TP53 (0.48) TP53LMNARXFP1THRBMET
SCHEMBL3885800 0.84 MET (0.49) TP53LMNARXFP1THRBMET
SCHEMBL5313555 0.83 MLKL (0.40) TP53THRBMETMAPTAXL
SCHEMBL3885761 0.81 MET (0.60) METAXLTYRO3LCKKIT
SCHEMBL13759620 0.79 MAPT (0.43) TP53LMNARXFP1THRBMET
SCHEMBL3883933 0.79 MET (0.45) TP53LMNARXFP1THRBMET
SCHEMBL5317938 0.77 TP53 (0.45) TP53LMNARXFP1THRBMAPT
SCHEMBL3886308 0.71 MET (0.48) TP53RXFP1THRBMETMAPT
SCHEMBL1753925 0.69 GAA (0.70) TP53THRBALDH1A1ATM

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
EP-1742948-A2 BICYCLIC HETEROCYCLES AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2007-01-17 — — EP claimed
WO-2005116028-A2 BICYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-12-08 — — WO claimed
US-20050239820-A1 Bicyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-10-27 — — US claimed
US-7566784-B2 Bicyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-07-28 — — US disclosed
US-7566784-B2 Bicyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-07-28 — — 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 (1 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-20050239820-A1 Bicyclic heterocycles as kinase inhibitors CDK2, ABL1, CDKN1A TP53 394/4885LMNA 3679/4885RXFP1 4578/4885

“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.

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