SCHEMBL31719087

SCHEMBL31719087

CN1CCN(CCCNC(=O)Nc2snc(OCc3cc(C(=O)NC4CC4)ccc3Cl)c2C(N)=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.50
PDGFRB P09619 7/20 0.50
FLT1 P17948 6/20 0.50
TGFBR1 P36897 2/20 0.50
ACVR1 Q04771 2/20 0.50
ALK Q9UM73 2/20 0.50
MAPK14 Q16539 2/20 0.50
PLK4 O00444 1/20 0.50
AURKA O14965 1/20 0.50
EPHB6 O15197 1/20 0.50
RIPK2 O43353 1/20 0.50
STK10 O94804 1/20 0.50
MAP4K4 O95819 1/20 0.50
ABL1 P00519 1/20 0.50
EGFR P00533 1/20 0.50
INSR P06213 1/20 0.50
LCK P06239 1/20 0.50
FYN P06241 1/20 0.50
YES1 P07947 1/20 0.50
LYN P07948 1/20 0.50

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
SCHEMBL31719507 0.93 KDR (0.42) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719135 0.92 KDR (0.60) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719067 0.92 KDR (0.55) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719055 0.90 KDR (0.49) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719570 0.89 KDR (0.42) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL3091098 0.88 KDR (0.55) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719485 0.87 KDR (0.51) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719309 0.87 KDR (0.55) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719439 0.86 KDR (0.50) KDRPDGFRBFLT1TGFBR1ACVR1
SCHEMBL31719438 0.86 KDR (0.50) KDRPDGFRBFLT1TGFBR1ACVR1

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-4644390-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF Beyang Therapeutics Co., Ltd. (CN) 2025-11-05 EP disclosed