SCHEMBL9342114

SCHEMBL9342114

Cc1nc(C2=CCCN(C)C2)cs1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.50
CHRM3 P20309 2/20 0.50
CHRM1 P11229 1/20 0.49

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
SCHEMBL9451991 0.84 CHRM2 (0.50) CHRM2CHRM3
SCHEMBL10433194 0.83 CHRM1 (0.51) CHRM2CHRM3CHRM1
SCHEMBL9772068 0.74 CHRM1 (0.44) CHRM2CHRM3CHRM1
SCHEMBL9343630 0.71 NPC1 (0.39)
SCHEMBL9342146 0.71 CHRM1 (0.53) CHRM2CHRM3CHRM1
SCHEMBL7267159 0.70 CDK1 (0.43) CHRM1
Hydrochloric Acid SCHEMBL7276876 0.70 CDK1 (0.42) CHRM1
SCHEMBL5139637 0.69 CHRM2 (0.55) CHRM2CHRM3CHRM1
SCHEMBL8402589 0.69 CHRM2 (0.55) CHRM2CHRM3CHRM1
SCHEMBL8404086 0.68 CHRM1 (0.56) CHRM2CHRM3CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5324723-A Analgesics MERCK SHARPE & DOHME LTD. 1994-06-28 US claimed
EP-0307141-B1 OXAZOLES AND THIAZOLES FOR THE TREATMENT OF SENILE DEMENTIA MERCK SHARP & DOHME LTD. (GB) 1993-01-13 EP claimed
EP-0307141-A2 Oxazoles and thiazoles for the treatment of senile dementia MERCK SHARP & DOHME LTD. (GB) 1989-03-15 EP claimed
US-5324723-A Analgesics MERCK SHARPE & DOHME LTD. 1994-06-28 US disclosed
EP-0307141-B1 OXAZOLES AND THIAZOLES FOR THE TREATMENT OF SENILE DEMENTIA MERCK SHARP & DOHME LTD. (GB) 1993-01-13 EP disclosed
EP-0307141-A2 Oxazoles and thiazoles for the treatment of senile dementia MERCK SHARP & DOHME LTD. (GB) 1989-03-15 EP disclosed