SCHEMBL13377142

SCHEMBL13377142

OC1C[C@@H]2CC3C[C@H](C1)N32

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
CYP2C9 P11712 1/20 0.48
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32

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
SCHEMBL21882378 1.00 LMNA (0.48) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL14495177 1.00 LMNA (0.48) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL23588703 0.84 LMNA (0.37) LMNACYP2C9
SCHEMBL11036944 0.80 LMNA (0.57) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL6745315 0.76
SCHEMBL17427862 0.73
SCHEMBL20206665 0.72 LMNA (0.43) LMNACYP2C9
SCHEMBL14161808 0.70 LMNA (0.46) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL23588970 0.70 LMNA (0.46) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL14175783 0.70 LMNA (0.46) LMNACYP2C9CHRM2CHRM1CHRM3

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-1960383-B1 5-SUBSTITUTED INDOLE-2-CARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-04-28 EP disclosed