SCHEMBL31592937

SCHEMBL31592937

c1cc(Nc2ncc(-c3ccoc3)cn2)cc(-c2nc3ccccc3[nH]2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 11/20 0.49
▸ ALDH1A1 P00352 6/20 0.49
▸ SMN1; SMN2 Q16637 6/20 0.49
▸ NPC1 O15118 4/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ HPGD P15428 4/20 0.49
▸ HTT P42858 1/20 0.49
▸ MEN1 O00255 5/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ MAPT P10636 6/20 0.48
▸ POLB P06746 5/20 0.48
▸ RECQL P46063 2/20 0.48
▸ THRB P10828 1/20 0.48
▸ ATM Q13315 1/20 0.48
▸ MMP2 P08253 3/20 0.47
▸ MMP9 P14780 3/20 0.47
▸ MMP8 P22894 3/20 0.47
▸ MMP13 P45452 2/20 0.47
▸ COMT P21964 1/20 0.47
▸ TP53 P04637 3/20 0.45

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
SCHEMBL31592792 0.84 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31592889 0.82 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31592798 0.82 KDM4E (0.51) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31592901 0.81 KDM4E (0.49) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31592949 0.81 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL27039994 0.81 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31592807 0.80 KDR (0.52) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31592923 0.79 MAPT (0.50) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31593011 0.78 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31592832 0.78 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A

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
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