SCHEMBL31723115

SCHEMBL31723115

O=C(O)c1coc2ccc(Cl)cc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.61
PTPN1 P18031 1/20 0.56
TTR P02766 2/20 0.55
MAOA P21397 2/20 0.54
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
GPR35 Q9HC97 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
NFKB1 P19838 1/20 0.48
HTT P42858 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48

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
SCHEMBL8399450 0.88 NPC1 (0.55) MAOBPTPN1TTRMAOANPC1
SCHEMBL23043447 0.87 MAOB (0.61) MAOBTTRMAOAALDH1A1KDM4E
SCHEMBL11262569 0.86 PTPN1 (0.55) MAOBPTPN1TTRMAOANPC1
SCHEMBL6720394 0.84 MAOB (0.51) MAOBPTPN1TTRMAOANPC1
SCHEMBL11262567 0.83 ALDH1A1 (0.48) MAOBPTPN1TTRMAOANPC1
SCHEMBL3344909 0.81 MAOB (0.61) MAOBPTPN1MAOANPC1RAB9A
SCHEMBL11513004 0.81 MAOB (0.67) MAOBMAOANPC1RAB9AMEN1
SCHEMBL4576015 0.81 MAOB (0.61) MAOBPTPN1MAOAMEN1KMT2A
SCHEMBL13856766 0.79 NPC1 (0.56) MAOBPTPN1TTRMAOANPC1
SCHEMBL11510079 0.78 MAOB (0.67) MAOBPTPN1MAOAALDH1A1

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