SCHEMBL31723150

SCHEMBL31723150

Cc1cccc(-c2oc3ccc(Cl)cc3c(=O)c2C(=O)O)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.70
MEN1 O00255 3/20 0.70
KMT2A Q03164 3/20 0.70
KDM4E B2RXH2 2/20 0.70
NPC1 O15118 2/20 0.70
RAB9A P51151 2/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
ALDH1A1 P00352 2/20 0.70
HPGD P15428 1/20 0.70
HTT P42858 1/20 0.70
ADORA3 P0DMS8 4/20 0.54
TP53 P04637 2/20 0.50
CSNK2A2 P19784 2/20 0.50
CSNK2B P67870 2/20 0.50
CSNK2A1 P68400 2/20 0.50
TTR P02766 2/20 0.49
ANO1 Q5XXA6 1/20 0.48
ALOX5 P09917 1/20 0.47
MCL1 Q07820 1/20 0.47
CA1 P00915 1/20 0.46

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
SCHEMBL28427581 1.00 MAPT (0.70) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL31723140 0.91 MAPT (0.59) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL20919306 0.91 MAPT (0.59) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL31723182 0.90 MAPT (0.85) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL20918213 0.90 MAPT (0.85) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL20918175 0.87 ALDH1A1 (0.57) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL31723124 0.87 ALDH1A1 (0.57) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL31723166 0.86 MAPT (0.70) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL31723137 0.85 KDM4E (0.72) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL28429262 0.85 KDM4E (0.72) MAPTMEN1KMT2AKDM4ENPC1

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-3699174-B1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2025-11-12 EP claimed