SCHEMBL31723120

SCHEMBL31723120

O=C(O)c1c(-c2cccc(F)c2)oc2ccccc2c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.57
KDM4E B2RXH2 6/20 0.57
MEN1 O00255 6/20 0.57
MAPT P10636 5/20 0.57
HPGD P15428 3/20 0.57
ALDH1A1 P00352 3/20 0.57
HTT P42858 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
GABRP O00591 1/20 0.52
GABRD O14764 1/20 0.52
GABRA1 P14867 1/20 0.52
GABRB1 P18505 1/20 0.52
GABRG2 P18507 1/20 0.52
GABRB3 P28472 1/20 0.52
GABRA5 P31644 1/20 0.52
GABRA3 P34903 1/20 0.52
GABRA2 P47869 1/20 0.52
GABRB2 P47870 1/20 0.52

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
SCHEMBL20918216 1.00 KMT2A (0.57) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL20919116 0.89 KMT2A (0.56) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL31723153 0.89 KMT2A (0.56) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL31723124 0.86 ALDH1A1 (0.57) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL20918175 0.86 ALDH1A1 (0.57) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL6527669 0.86 ALDH1A1 (0.69) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL20918191 0.85 MAPT (0.77) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL22284777 0.85 TTR (0.49) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL31723173 0.85 MAPT (0.77) KMT2AKDM4EMEN1MAPTHPGD
SCHEMBL31723151 0.85 TTR (0.49) KMT2AKDM4EMEN1MAPTHPGD

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