SCHEMBL9012010

SCHEMBL9012010

c1ccc(C[C]2CCCCC2C2CCCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
HPGD P15428 2/20 0.40
USP2 O75604 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MT-CO2 P00403 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPT P10636 1/20 0.37
CALM1 P0DP23 1/20 0.37
LTA4H P09960 2/20 0.36
ALPL P05186 1/20 0.36
EPHX2 P34913 1/20 0.36
POLB P06746 2/20 0.36
HRH3 Q9Y5N1 1/20 0.35
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
HSD11B1 P28845 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
SCHEMBL7960836 0.76 HSD11B1 (0.44) HPGDUSP2HSD17B10CALM1POLB
SCHEMBL23860295 0.76 HSD11B1 (0.44) HPGDUSP2HSD17B10CALM1POLB
SCHEMBL18550001 0.75 CALM1 (0.39) ALDH1A1MT-CO2ALOX5CALM1LTA4H
SCHEMBL15743127 0.74 DDB1 (0.42) CALM1LTA4HPOLBHSD11B1
SCHEMBL6586984 0.71 CALM1 (0.52) CALM1LTA4HPOLBHRH3
SCHEMBL1829180 0.71 CALM1 (0.52) CALM1LTA4HPOLBHRH3
SCHEMBL2051544 0.71 CALM1 (0.52) CALM1LTA4HPOLBHRH3
SCHEMBL8065016 0.69 MAPT (0.40) ALDH1A1HPGDMT-CO2ALOX5MAPT
SCHEMBL7837228 0.69 MAPT (0.40) ALDH1A1HPGDMT-CO2ALOX5MAPT
SCHEMBL6275122 0.69 MAPT (0.40) ALDH1A1HPGDMT-CO2ALOX5MAPT

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
EP-0534700-B1 Process for cycloalkyl substitution of hydrogen containing silanes DOW CORNING (US) 1996-11-20 EP disclosed