SCHEMBL27423331

SCHEMBL27423331

c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5nc6cccnc6o5)cc4)cc3)cc2)c2ccc(-c3nc4cccnc4o3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
TP53 P04637 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HSD17B10 Q99714 1/20 0.49
SGMS2 Q8NHU3 8/20 0.46
APP P05067 2/20 0.42
ADRB2 P07550 1/20 0.40
DHODH Q02127 1/20 0.40
ELANE P08246 1/20 0.39
MAPT P10636 1/20 0.39
MAOB P27338 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL27424130 1.00 NPC1 (0.49) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27424133 0.99 ALDH1A1 (0.48) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27424623 0.99 NPC1 (0.50) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27424635 0.94 NPC1 (0.49) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27424252 0.94 NPC1 (0.49) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27424131 0.91 ALDH1A1 (0.43) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27423977 0.91 ALDH1A1 (0.43) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27424519 0.91 ALDH1A1 (0.45) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27424622 0.88 ALDH1A1 (0.45) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27200964 0.88 ALDH1A1 (0.45) NPC1RAB9AALDH1A1KDM4EHPGD

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
EP-4389753-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND COMPOUND FOR SAME Hodogaya Chemical Co., Ltd. (JP) 2024-06-26 EP disclosed