SCHEMBL8891772

SCHEMBL8891772

CSc1ccc(C(=O)c2cnoc2C2CC2)c(Cc2ccc(Cl)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
SLC5A1 P13866 2/20 0.33
SLC5A2 P31639 2/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
HPGD P15428 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
HCRTR2 O43614 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL8892485 0.90 MAPT (0.35) KMT2AALDH1A1RAB9AKDM4ENPC1
SCHEMBL8891282 0.90 HPGD (0.36) KMT2AMEN1ALDH1A1L3MBTL1RAB9A
SCHEMBL8889854 0.86 SMN1; SMN2 (0.34) KMT2AMEN1ALDH1A1HTTRAB9A
SCHEMBL8494970 0.86 HPGD (0.35) KMT2AMEN1ALDH1A1RAB9AHPGD
SCHEMBL8892612 0.84 TBXA2R (0.36) KMT2AMEN1HPGDSMN1; SMN2MAPT
SCHEMBL8890896 0.84 TBXA2R (0.41) KMT2AMEN1ALDH1A1KDM4ESLC5A1
SCHEMBL7576529 0.84 HPGD (0.34) KMT2AMEN1ALDH1A1RAB9AHPGD
SCHEMBL8817069 0.83 PKM (0.34) ALDH1A1RAB9AHPGDPKMDHODH
SCHEMBL8893425 0.83 KDM4E (0.33) KMT2AMEN1ALDH1A1L3MBTL1RAB9A
SCHEMBL8891685 0.83 PTGS2 (0.38) KMT2AMEN1

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
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed