SCHEMBL9817013

SCHEMBL9817013

CCc1cc(C(CC)(c2ccccc2)C(CC)(CC)CC)c(CC)c(CC)c1CC

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
KIF11 P52732 1/20 0.31
KCNN4 O15554 1/20 0.30

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
SCHEMBL9817129 0.88 ESR1 (0.30) ESR1ESR2KCNN4
SCHEMBL9817076 0.80 GABRA1 (0.36) ESR1ESR2KIF11KCNN4
SCHEMBL2260217 0.79 KIF11 (0.38) KIF11KCNN4
SCHEMBL9817084 0.75 KCNN4 (0.43) KIF11KCNN4
SCHEMBL11689791 0.73 KIF11 (0.35) KIF11
SCHEMBL30182809 0.72 KIF11 (0.32) KIF11
SCHEMBL8522728 0.69 KIF11 (0.35) KIF11KCNN4
SCHEMBL1059140 0.69 KCNN4 (0.48) ESR1ESR2KCNN4
SCHEMBL6737771 0.67 KIF11 (0.37) KIF11KCNN4
SCHEMBL29601751 0.67 KIF11 (0.37) KIF11KCNN4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0282064-B1 METHOD FOR PRODUCING M-ETHYLDIPHENYLS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-10-23 EP disclosed
US-4835337-A Method for producing m-ethyldiphenyls NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-05-30 US disclosed
EP-0282064-A1 Method for producing m-ethyldiphenyls NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-14 EP disclosed