SCHEMBL11295099

SCHEMBL11295099

COc1ccc2c(c1)CC(NC(C)=O)C2(C)C

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 12/20 0.55
MTNR1B P49286 7/20 0.55
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
ACHE P22303 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
NQO2 P16083 3/20 0.40

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
SCHEMBL11295469 0.90 MTNR1A (0.53) MTNR1AMTNR1BCA1CA2ACHE
SCHEMBL11291111 0.81 MTNR1A (0.39) MTNR1AMTNR1BCA1CA2SMN1; SMN2
SCHEMBL14196062 0.77 AR (0.44) MTNR1AMTNR1BCA1CA2
SCHEMBL5751441 0.77 MTNR1A (0.46) MTNR1AMTNR1BSMN1; SMN2
Hydrochloric Acid SCHEMBL11305840 0.77 DRD2 (0.44)
SCHEMBL11312993 0.76 MEN1 (0.41) MTNR1AMTNR1BACHESMN1; SMN2NQO2
SCHEMBL11310753 0.76 MTNR1A (0.50) MTNR1AMTNR1BNQO2
SCHEMBL5780440 0.75 MCHR2 (0.35) MTNR1AMTNR1BCA1CA2
Hydrochloric Acid SCHEMBL11316278 0.75 MEN1 (0.40) MTNR1AMTNR1BACHESMN1; SMN2NQO2
SCHEMBL6400837 0.75 ALDH1A1 (0.40) CA1CA2SMN1; SMN2

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-0005821-B1 INDANAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Hokuriku Pharmaceutical Co.,Ltd (JP) 1982-12-08 EP disclosed
EP-0005821-A1 Indanamine derivatives, process for their preparation and medicaments containing them Hokuriku Pharmaceutical Co.,Ltd (JP) 1979-12-12 EP disclosed