SCHEMBL18985234

SCHEMBL18985234

CCc1cc[nH]c(=S)c1C(=O)N(C)CC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.35
DAO P14920 1/20 0.34
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL18985307 0.74 GAA (0.56) PIN1TDP1KDM4EGAAMAPT
SCHEMBL11107022 0.65 HDAC1 (0.45) PIN1KDM4EMAPT
SCHEMBL29205065 0.63 NAPRT (0.41) TDP1KDM4EGAAMAPT
SCHEMBL2282162 0.62 KMT2A (0.53) PIN1
SCHEMBL24687419 0.62 HDAC6 (0.44) PIN1DAOTSHRTDP1
SCHEMBL11304284 0.62 PIN1 (0.36) PIN1DAOALOX15TSHRCYP2C19
Hydrochloric Acid SCHEMBL1372985 0.61 KMT2A (0.51) PIN1MAPT
SCHEMBL519233 0.60 ALDH1A1 (0.39) CYP2C19HIF1AKDM4EGAAMAPT
SCHEMBL15108901 0.60 KMT2A (0.58) TSHRGAA
SCHEMBL15782805 0.60 CA12 (0.44) DAOKDM4EGAAMAPT

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-3390363-A1 PROCESS FOR DEPIGMENTING KERATIN MATERIALS USING THIOPYRIDINONE COMPOUNDS L'OREAL (FR) 2018-10-24 EP disclosed
WO-2017102349-A1 PROCESS FOR DEPIGMENTING KERATIN MATERIALS USING THIOPYRIDINONE COMPOUNDS L'OREAL (FR) 2017-06-22 WO disclosed