SCHEMBL9712437

SCHEMBL9712437

Cc1cccc(C(=O)Cl)c1C(=O)c1ccc(C(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ESRRA P11474 1/20 0.40
CYP2C9 P11712 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
HTT P42858 3/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
PLA2G1B P04054 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
USP5 P45974 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.35

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
Hydrochloric Acid SCHEMBL8174895 0.89 ESRRA (0.34) CNR1CNR2ESRRASMN1; SMN2HTT
SCHEMBL9712837 0.83 ALDH1A1 (0.39) CYP2C9SMN1; SMN2HTTRAB9ANPC1
SCHEMBL27321464 0.82 AKR1C3 (0.46) CYP2C9HTTRAB9ANPC1ALDH1A1
SCHEMBL9712580 0.81 NR4A1 (0.50) CNR1CNR2CYP2C9ALDH1A1KMT2A
SCHEMBL9712475 0.79 ALDH1A1 (0.43) CNR1CNR2SMN1; SMN2HTTRAB9A
SCHEMBL9712552 0.79 KMT2A (0.55) CYP2C9SMN1; SMN2HTTRAB9ANPC1
SCHEMBL9712383 0.78 TAS1R3 (0.35) CYP2C9SMN1; SMN2HTTRAB9ANPC1
SCHEMBL9712598 0.78 CA1 (0.41) SMN1; SMN2RAB9ANPC1ALDH1A1L3MBTL1
SCHEMBL9712518 0.78 NPC1 (0.48) CNR1CNR2SMN1; SMN2HTTRAB9A
SCHEMBL9712495 0.77 GAA (0.44) CNR2SMN1; SMN2HTTRAB9ANPC1

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