SCHEMBL9712508

SCHEMBL9712508

CCc1ccc(C(=O)c2cc(Cl)ccc2[C]=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.49
EGFR P00533 1/20 0.48
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
ALDH1A1 P00352 4/20 0.47
LMNA P02545 2/20 0.47
AGTR1 P30556 2/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.46
NLRP1 Q9C000 1/20 0.46
MAPT P10636 4/20 0.46
PLK1 P53350 1/20 0.42
CBX7 O95931 1/20 0.41
CDYL2 Q8N8U2 1/20 0.41
CDYL Q9Y232 1/20 0.41
CDY1; CDY1B Q9Y6F8 1/20 0.41
RAB9A P51151 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9712510 0.86 CNR2 (0.52) GAACNR2ALDH1A1POLBPLK1
SCHEMBL9063310 0.83 GAA (0.59) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL48194 0.82 CNR2 (0.57) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL3154810 0.81 ALDH1A1 (0.52) GAACNR2ALDH1A1LMNANPC1
SCHEMBL4849572 0.81 RECQL (0.53) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL9712382 0.79 RAB9A (0.48) CNR1CNR2ALDH1A1LMNANPC1
SCHEMBL9712581 0.78 PLK1 (0.44) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL28399335 0.77 ALDH1A1 (0.65) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL8796385 0.77 SRD5A2 (0.55) ALDH1A1POLBMAPK1RAB9ASRD5A2
SCHEMBL9712369 0.76 MDM2 (0.47) LMNAMAPK1MAPTRAB9AHTT

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