SCHEMBL11601480

SCHEMBL11601480

CCCCCCC(C)(C)c1cc(OCc2ccccc2)c(C2=C(C(C)(C)C#N)CCC(C)C2)c(OCc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 17/20 0.44
▸ CNR1 P21554 10/20 0.44
▸ GPR55 Q9Y2T6 1/20 0.36
▸ HTR2C P28335 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ SGMS2 Q8NHU3 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL11603349 0.86 CNR2 (0.44) CNR2CNR1GPR55
SCHEMBL11602993 0.85 CNR2 (0.43) CNR2CNR1GPR55NR1H4
SCHEMBL11601025 0.85 CNR2 (0.43) CNR2CNR1GPR55NR1H4
SCHEMBL11604641 0.83 CNR2 (0.46) CNR2CNR1GPR55
SCHEMBL11602882 0.83 CNR2 (0.46) CNR2CNR1GPR55NR1H4
SCHEMBL11601904 0.81 CNR2 (0.44) CNR2CNR1GPR55NR1H4
SCHEMBL11604209 0.80 CNR2 (0.43) CNR2CNR1GPR55NR1H4
SCHEMBL11601473 0.77 CNR1 (0.33) CNR2CNR1GPR55
SCHEMBL11603875 0.77 CNR2 (0.43) CNR2CNR1GPR55
SCHEMBL11605436 0.74 SGMS2 (0.32) SGMS2

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-4092344-A Cyclohexenyl resorcinol derivatives ELI LILLY AND COMPANY (US) 1978-05-30 — — US disclosed
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