SCHEMBL9712450

SCHEMBL9712450

Cc1ccc(C(=O)c2c(Cl)cc(Cl)cc2[C]=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
LMNA P02545 3/20 0.46
ALDH1A1 P00352 2/20 0.46
CES2 O00748 2/20 0.43
CES1 P23141 2/20 0.43
SRD5A2 P31213 2/20 0.41
PTGS2 P35354 1/20 0.39
MAPT P10636 5/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 2/20 0.37
TP53 P04637 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 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
SCHEMBL9712397 0.89 SRD5A2 (0.44) CNR1CNR2CES2CES1SRD5A2
SCHEMBL9712427 0.79 ALDH1A1 (0.47) CNR1CNR2LMNAALDH1A1CES2
SCHEMBL9712524 0.76 ALDH1A1 (0.47) CNR1CNR2LMNAALDH1A1CES2
SCHEMBL9712594 0.76 ALDH1A1 (0.47) CNR1CNR2LMNAALDH1A1CES2
SCHEMBL28157442 0.72 CNR2 (0.69) CNR1CNR2LMNAALDH1A1CES2
SCHEMBL9712382 0.72 RAB9A (0.48) CNR1CNR2LMNAALDH1A1CES2
SCHEMBL7264321 0.71 CES2 (0.53) CNR1CNR2LMNAALDH1A1CES2
SCHEMBL4346543 0.70 SRD5A2 (0.70) CNR1CNR2LMNAALDH1A1CES2
SCHEMBL363400 0.70 ALDH1A1 (0.52) LMNAALDH1A1CES2CES1SRD5A2
SCHEMBL14135917 0.69 ALDH1A1 (0.76) CNR1CNR2LMNAALDH1A1CES2

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
US-5117057-A Insecticidal N' substituted-N-N'-disubstituted-hydrazines ROHM AND HAAS COMPANY (US) 1992-05-26 US disclosed