SCHEMBL7755595

SCHEMBL7755595

CCCn1ccc(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.48
KDM5B Q9UGL1 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
PLA2G4A P47712 1/20 0.45
CNR1 P21554 1/20 0.43
AKR1B1 P15121 1/20 0.43
ALDH1A1 P00352 2/20 0.40
HCAR3 P49019 2/20 0.40
HPGD P15428 1/20 0.40
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
ALOX15 P16050 1/20 0.38
RARB P10826 1/20 0.36
TP53 P04637 2/20 0.36
TSHR P16473 2/20 0.36
JMJD6 Q6NYC1 1/20 0.36

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
SCHEMBL21413172 0.86 CNR1 (0.56) PLA2G4ACNR1ALDH1A1KDM4EPOLB
SCHEMBL9150323 0.86 CNR1 (0.56) PLA2G4ACNR1ALDH1A1KDM4EPOLB
SCHEMBL22291138 0.86 CNR1 (0.56) PLA2G4ACNR1ALDH1A1KDM4EPOLB
SCHEMBL15098118 0.85 CNR1 (0.43) KDM5AKDM5BL3MBTL1PLA2G4ACNR1
SCHEMBL29132913 0.84 PLA2G4A (0.43) KDM5AKDM5BL3MBTL1PLA2G4ACNR1
SCHEMBL969727 0.84 AKR1B1 (0.46) KDM5AKDM5BL3MBTL1PLA2G4ACNR1
SCHEMBL29132872 0.82 CNR1 (0.46) KDM5AKDM5BL3MBTL1PLA2G4ACNR1
SCHEMBL26134331 0.81 AKR1B1 (0.43) L3MBTL1PLA2G4ACNR1AKR1B1ALDH1A1
SCHEMBL22063999 0.80 ALDH1A1 (0.47) PLA2G4AAKR1B1ALDH1A1HCAR3
SCHEMBL22748618 0.78 PLA2G4A (0.50) PLA2G4ACNR1RARBTP53TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023154519-A1 INHIBITORS OF RNA HELICASE DHX9 AND USES THEREOF ACCENT THERAPEUTICS, INC. (US) 2023-08-17 WO disclosed
EP-1071427-A1 INTERMITTENT CLAUDICATION THERAPEUTIC DRUGS COMPRISING PYRROLOAZEPINES SUNTORY LIMITED (JP) 2001-01-31 EP disclosed
WO-2000048602-A1 INTERMITTENT CLAUDICATION THERAPEUTIC DRUGS COMPRISING PYRROLOAZEPINES SUNTORY LIMITED (JP) 2000-08-24 WO disclosed