SCHEMBL11036944

SCHEMBL11036944

OC1CC2CCC(C1)N2C1CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
CYP2C9 P11712 1/20 0.57
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
OPRL1 P41146 1/20 0.34
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD11B1 P28845 1/20 0.32
AR P10275 2/20 0.31
SLC18A3 Q16572 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
TSHR P16473 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
SCHEMBL14175783 0.82 LMNA (0.46) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL14161808 0.82 LMNA (0.46) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL23588970 0.82 LMNA (0.46) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL21882378 0.80 LMNA (0.48) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL13377142 0.80 LMNA (0.48) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL14495177 0.80 LMNA (0.48) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL26290985 0.77 LMNA (0.38) LMNACYP2C9MEN1CYP2D6KMT2A
SCHEMBL22408562 0.77 LMNA (0.41) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL22408564 0.77 LMNA (0.41) LMNACYP2C9CHRM2CHRM1CHRM3
SCHEMBL23262204 0.75 LMNA (0.57) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0042365-B1 SALTS OF ENDO-8-METHYL-8-SYN-ALKYL-8-AZONIABICYCLO-(3.2.1)-OCTANE-3-ALKYLCARBOXYLATES, PROCESS FOR THEIR PREPARATION AND THERAPEUTIC COMPOSITIONS CONTAINING THEM VALEAS S.p.A. INDUSTRIA CHIMICA E FARMACEUTICA (IT) 1984-09-12 EP disclosed
US-4411902-A ANTISPASMODICS VALEAS S.P.A. (IT) 1983-10-25 US disclosed
EP-0042365-A1 Salts of endo-8-methyl-8-syn-alkyl-8-azoniabicyclo-(3.2.1)-octane-3-alkylcarboxylates, process for their preparation and therapeutic compositions containing them VALEAS S.p.A. INDUSTRIA CHIMICA E FARMACEUTICA (IT) 1981-12-23 EP disclosed