SCHEMBL5024317

SCHEMBL5024317

CC(C)CCCc1[c]ccc2cc3ccccc3cc12

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
BCHE P06276 1/20 0.32
ESR1 P03372 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
SCHEMBL2253861 0.84 MAPT (0.37) BCHE
SCHEMBL2251595 0.82 MAPT (0.44)
SCHEMBL2258052 0.82 MAPT (0.44)
SCHEMBL5748802 0.82 MAPT (0.44)
SCHEMBL8176752 0.78 ALDH1A1 (0.36) ESR1
SCHEMBL5745901 0.77 CYP1A2 (0.39)
SCHEMBL2252836 0.71 GAA (0.39)
SCHEMBL4629536 0.70 KCNH2 (0.42)
SCHEMBL10760575 0.69 KCNH2 (0.44)
SCHEMBL292073 0.69 KCNH2 (0.44)

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-1916244-A1 THIOPHENE COMPOUND HAVING SULFONYL GROUP AND PROCESS FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2008-04-30 EP disclosed