SCHEMBL31592792

SCHEMBL31592792

c1cc(Nc2ncc(-c3cncnc3)cn2)cc(-c2nc3ccccc3[nH]2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.55
▸ SMN1; SMN2 Q16637 6/20 0.55
▸ ALDH1A1 P00352 5/20 0.55
▸ NPC1 O15118 4/20 0.55
▸ RAB9A P51151 4/20 0.55
▸ HPGD P15428 3/20 0.55
▸ HTT P42858 1/20 0.55
▸ LDHA P00338 1/20 0.53
▸ EPHX2 P34913 1/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ MAPT P10636 7/20 0.52
▸ POLB P06746 3/20 0.52
▸ THRB P10828 1/20 0.52
▸ RECQL P46063 1/20 0.52
▸ ATM Q13315 1/20 0.52
▸ MMP2 P08253 3/20 0.51
▸ MMP9 P14780 3/20 0.51
▸ MMP8 P22894 3/20 0.51
▸ MMP13 P45452 2/20 0.51

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
SCHEMBL27039896 0.90 KDM4E (0.57) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31592814 0.90 KDM4E (0.57) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31592903 0.87 KDM4E (0.54) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL27040075 0.87 KDM4E (0.54) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31592889 0.86 KDM4E (0.55) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31593011 0.86 KDM4E (0.53) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31592901 0.84 KDM4E (0.49) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31592937 0.84 KDM4E (0.49) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31592949 0.84 KDM4E (0.53) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL27039994 0.84 KDM4E (0.53) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A

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