SCHEMBL18615387

SCHEMBL18615387

CNC(=O)c1cc(-c2ccc(CN3CCC(N4CCCC4)CC3)c(N)c2)cnc1N

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MERTK Q12866 12/20 0.65
▸ AXL P30530 11/20 0.65
▸ ACVR1 Q04771 7/20 0.47
▸ BMPR1B O00238 6/20 0.47
▸ BMPR1A P36894 6/20 0.47
▸ TGFBR1 P36897 6/20 0.47
▸ ACVRL1 P37023 6/20 0.47
▸ PIK3C3 Q8NEB9 1/20 0.46

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
SCHEMBL21779419 0.90 MERTK (0.61) MERTKAXLACVR1BMPR1BBMPR1A
SCHEMBL18616315 0.80 MERTK (0.60) MERTKAXLACVR1BMPR1BBMPR1A
SCHEMBL18581004 0.80 AXL (1.00) MERTKAXL
SCHEMBL18611887 0.77 MERTK (0.59) MERTKAXLACVR1BMPR1BBMPR1A
SCHEMBL18580395 0.73 AXL (0.89) MERTKAXL
SCHEMBL18579601 0.73 MERTK (1.00) MERTKAXL
SCHEMBL18615845 0.72 AXL (0.62) MERTKAXLACVR1BMPR1BBMPR1A
SCHEMBL18612199 0.72 L3MBTL3 (0.59) MERTKAXLPIK3C3
SCHEMBL18616643 0.72 AXL (0.66) MERTKAXLACVR1BMPR1BBMPR1A
SCHEMBL18616607 0.71 MERTK (0.65) MERTKAXLACVR1BMPR1BBMPR1A

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
WO-2017039331-A1 HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2017-03-09 — — WO disclosed
Send feedback