SCHEMBL8128174

SCHEMBL8128174

O=c1[nH]c2cc(Nc3ccncc3)ncc2cc1Cc1c(Cl)cccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 8/20 0.47
▸ SRC P12931 7/20 0.47
▸ IDH1 O75874 5/20 0.40
▸ EGFR P00533 2/20 0.39
▸ CCNA2 P20248 3/20 0.38
▸ CDK2 P24941 3/20 0.38
▸ TTK P33981 3/20 0.38
▸ AURKA O14965 2/20 0.38
▸ AURKB Q96GD4 1/20 0.36
▸ JAK2 O60674 1/20 0.35
▸ TYK2 P29597 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ FYN P06241 2/20 0.34

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
SCHEMBL5332258 0.88 FGFR1 (0.48) FGFR1SRCIDH1CCNA2CDK2
SCHEMBL10276720 0.73 FGFR1 (0.65) FGFR1SRCEGFRCCNA2CDK2
SCHEMBL16332688 0.69 FYN (0.54) CCNA2CDK2TTKAURKAAURKB
SCHEMBL23289853 0.67 FGFR4 (0.54) FGFR1SRCCCNA2CDK2TTK
SCHEMBL16332357 0.67 CYP19A1 (0.53) CCNA2CDK2TTKAURKAAURKB
SCHEMBL6640590 0.64 SRC (0.76) FGFR1SRCEGFR
SCHEMBL6642822 0.64 FGFR1 (1.00) FGFR1SRCEGFR
SCHEMBL24852768 0.60 NAMPT (0.47) IDH1
SCHEMBL30634476 0.60 GRIN2D (0.45) IDH1
SCHEMBL30880085 0.60 TTK (0.56) CCNA2CDK2TTKAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1003745-A1 NAPHTHYRIDINONES FOR INHIBITING PROTEIN TYROSINE KINASE AND CELL CYCLE KINASE MEDIATED CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY LLC (US) 2000-05-31 — — EP disclosed
WO-1999009030-A1 NAPHTHYRIDINONES FOR INHIBITING PROTEIN TYROSINE KINASE AND CELL CYCLE KINASE MEDIATED CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-02-25 — — WO disclosed
Send feedback