SCHEMBL31592791

SCHEMBL31592791

N#Cc1ccc(Nc2cccc(-c3nc4ccc(C(F)(F)F)cc4[nH]3)c2)nc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 6/20 0.60
▸ KCNH2 Q12809 5/20 0.60
▸ SOAT1 P35610 1/20 0.60
▸ NPBWR1 P48145 9/20 0.52
▸ KDR P35968 1/20 0.46
▸ KIT P10721 1/20 0.45
▸ DYRK1A Q13627 1/20 0.43
▸ DYRK1B Q9Y463 1/20 0.43
▸ CBFB Q13951 1/20 0.43

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
SCHEMBL31592859 0.87 DGAT1 (0.69) DGAT1KCNH2SOAT1NPBWR1KDR
SCHEMBL31593020 0.86 DGAT1 (0.66) DGAT1KCNH2SOAT1NPBWR1KDR
SCHEMBL31593002 0.85 DGAT1 (0.72) DGAT1KCNH2SOAT1NPBWR1KDR
SCHEMBL27039936 0.85 DGAT1 (0.55) DGAT1KCNH2SOAT1NPBWR1KDR
SCHEMBL31592851 0.85 DGAT1 (0.55) DGAT1KCNH2SOAT1NPBWR1KDR
SCHEMBL31592941 0.84 DGAT1 (0.54) DGAT1KCNH2SOAT1NPBWR1KDR
SCHEMBL31593000 0.82 DGAT1 (0.52) DGAT1KCNH2SOAT1NPBWR1KDR
SCHEMBL31593053 0.81 CBFB (0.60) DGAT1KCNH2NPBWR1KDRKIT
SCHEMBL31592909 0.79 KCNH2 (0.64) DGAT1KCNH2SOAT1NPBWR1
SCHEMBL31592960 0.78 NPBWR1 (0.61) DGAT1KCNH2SOAT1NPBWR1KDR

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-4559908-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF S2CBio Inc. (KR) 2025-05-28 — — EP claimed
EP-4559908-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF S2CBio Inc. (KR) 2025-05-28 — — EP disclosed
Send feedback