SCHEMBL31723167

SCHEMBL31723167

Cc1ccc2c(=O)c(C(=O)O)c(-c3cccc(F)c3)oc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.62
KDM4E B2RXH2 4/20 0.62
ALDH1A1 P00352 3/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
NPC1 O15118 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
HPGD P15428 2/20 0.62
HTT P42858 1/20 0.62
RAB9A P51151 1/20 0.62
ANO1 Q5XXA6 6/20 0.48
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PTPN2 P17706 2/20 0.41
PTPN1 P18031 2/20 0.41
PTPN6 P29350 2/20 0.41
DUSP3 P51452 2/20 0.41

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
SCHEMBL28427603 1.00 MAPT (0.62) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL31723173 0.91 MAPT (0.77) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL20918191 0.91 MAPT (0.77) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL28431175 0.90 MAPT (0.68) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL31723158 0.90 MAPT (0.68) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL31723154 0.89 MAPT (0.60) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL20919240 0.89 MAPT (0.60) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL22284777 0.86 TTR (0.49) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL31723151 0.86 TTR (0.49) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL20918138 0.85 ALDH1A1 (0.56) MAPTKDM4EALDH1A1MEN1KMT2A

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