SCHEMBL2654882

SCHEMBL2654882

CCCCC1(C)C=C(O)C=CC1c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 6/20 0.32
KDM1A O60341 2/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
OPRK1 P41145 1/20 0.30
OPRL1 P41146 1/20 0.30
ELANE P08246 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
SCHEMBL2654017 0.73 OPRM1 (0.32) SLC10A2KDM1AMAOAMAOBKDM4E
SCHEMBL2653461 0.73 CHRNA7 (0.30) KDM1AMAOAMAOB
SCHEMBL30939676 0.69 SLC10A2 (0.33) SLC10A2KDM4EPKM
SCHEMBL23396586 0.59 KDM1A (0.37) KDM1AMAOAMAOB
SCHEMBL11833585 0.59 KDM1A (0.39) SLC10A2KDM1AMAOAMAOBKDM4E
SCHEMBL10674140 0.58 KDM1A (0.38) KDM1AMAOAMAOB
SCHEMBL9852458 0.57 OPRM1 (0.39) KDM1AMAOAMAOBOPRM1OPRD1
Phenol SCHEMBL27513359 0.56 CA12 (0.61) KDM4EOPRM1OPRD1OPRK1
Phenol SCHEMBL27577782 0.56 CA12 (0.61) KDM4EOPRM1OPRD1OPRK1
Phenol SCHEMBL28185432 0.56 CA12 (0.61) KDM4EOPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856090-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-11-21 EP disclosed
WO-2006086488-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-08-17 WO disclosed