SCHEMBL29624496

SCHEMBL29624496

c1ccc(-c2ccc(Sc3cc4ccccc4[nH]3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.50
RAB9A P51151 3/20 0.50
AR P10275 1/20 0.44
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 2/20 0.41
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
CNR1 P21554 1/20 0.40
AOC3 Q16853 2/20 0.40
DAO P14920 1/20 0.40
SRD5A2 P31213 1/20 0.40

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
SCHEMBL6824543 0.89 AR (0.49) NPC1RAB9AARKDM4EMAPT
SCHEMBL28782688 0.83 BRD4 (0.47) NPC1RAB9AARKDM4EMAPT
SCHEMBL8960942 0.83 FLT3 (0.44) NPC1RAB9AARKDM4EMAPT
Biphenyl SCHEMBL9470119 0.82 NPC1 (0.57) NPC1RAB9AARKDM4EMAPT
SCHEMBL10613155 0.81 AOC3 (0.52) NPC1RAB9AARKDM4EMAPT
SCHEMBL9328485 0.73 AOC3 (0.52) NPC1RAB9AARKDM4EMAPT
SCHEMBL30990546 0.73 AOC3 (0.52) NPC1RAB9AARKDM4EMAPT
SCHEMBL10997076 0.72 NPC1 (0.92) NPC1RAB9AKDM4EMAPTHPGD
SCHEMBL31465196 0.71 TUBB4A (0.37) NPC1RAB9AARKDM4EMAPT
SCHEMBL18427579 0.71 AOC3 (0.50) NPC1RAB9AARKDM4EMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478354-A 1, 3-disubstituted indole derivatives as hyaluronidase inhibitor and application thereof in cosmetic products 北京青颜博识健康管理有限公司 2022-05-13 CN claimed
CN-114478354-B 1, 3-disubstituted indole derivatives as hyaluronidase inhibitor and application thereof in cosmetic products 北京青颜博识健康管理有限公司 2022-09-23 CN disclosed
CN-114478354-A 1, 3-disubstituted indole derivatives as hyaluronidase inhibitor and application thereof in cosmetic products 北京青颜博识健康管理有限公司 2022-05-13 CN disclosed