SCHEMBL10673441

SCHEMBL10673441

COc1ccccc1C1CCCCC1OC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 1/20 0.57
FABP3 P05413 1/20 0.57
FABP5 Q01469 1/20 0.57
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HTR2C P28335 3/20 0.44
SLC18A3 Q16572 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PIN1 Q13526 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2B P41595 1/20 0.41
POLB P06746 2/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL10673437 1.00 FABP7 (0.57) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL9282834 0.82 HTR1D (0.44) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL9282830 0.82 HTR1D (0.44) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL4193266 0.77 FABP5 (0.61) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL19355089 0.77 FABP5 (0.61) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL15570630 0.77 FABP5 (0.61) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL19355194 0.77 FABP5 (0.61) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL19355090 0.77 FABP5 (0.61) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL4193263 0.77 FABP5 (0.61) FABP7FABP3FABP5MEN1KMT2A
SCHEMBL9278538 0.75 HTR2C (0.47) FABP7FABP3FABP5MEN1KMT2A

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-4736057-A Cyclohexane derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-04-05 US disclosed