SCHEMBL31592807

SCHEMBL31592807

Fc1ccnc(-c2cnc(Nc3cccc(-c4nc5ccccc5[nH]4)c3)nc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 4/20 0.52
▸ KDM4E B2RXH2 9/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ ALDH1A1 P00352 5/20 0.51
▸ NPC1 O15118 4/20 0.51
▸ RAB9A P51151 4/20 0.51
▸ HPGD P15428 3/20 0.51
▸ HTT P42858 1/20 0.51
▸ MAPT P10636 6/20 0.49
▸ MMP2 P08253 2/20 0.49
▸ MMP9 P14780 2/20 0.49
▸ MMP8 P22894 2/20 0.49
▸ MMP13 P45452 2/20 0.49
▸ COMT P21964 1/20 0.49
▸ TP53 P04637 3/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ MET P08581 1/20 0.48
▸ POLB P06746 4/20 0.47
▸ RECQL P46063 2/20 0.47

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
SCHEMBL27039994 0.88 KDM4E (0.53) KDRKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL31592949 0.88 KDM4E (0.53) KDRKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL31592923 0.86 MAPT (0.50) KDRKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL31592897 0.84 CBFB (0.61) KDRKDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL31592889 0.84 KDM4E (0.55) KDRKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL31593011 0.83 KDM4E (0.53) KDRKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL31592832 0.83 KDM4E (0.53) KDRKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL31592792 0.81 KDM4E (0.55) KDRKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL31592834 0.81 KDM4E (0.56) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31592798 0.81 KDM4E (0.51) KDRKDM4ESMN1; SMN2ALDH1A1NPC1

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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