Sugi Predict

Sugi Predict / Compounds / SCHEMBL7841981

SCHEMBL7841981

SCHEMBL7841981

Cc1cccc(CN2CCC(NC(=O)[C@](O)(c3ccccc3)C3CCCC3)CC2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 20/20 1.00
▸ CHRM1 P11229 20/20 1.00
▸ CHRM3 P20309 20/20 1.00

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
Hydrochloric Acid SCHEMBL7831027 0.99 CHRM2 (0.98) CHRM2CHRM1CHRM3
SCHEMBL7842929 0.90 CHRM2 (0.82) CHRM2CHRM1CHRM3
SCHEMBL7831385 0.89 CHRM2 (0.79) CHRM2CHRM1CHRM3
SCHEMBL7849712 0.88 CHRM2 (0.78) CHRM2CHRM1CHRM3
Hydrochloric Acid SCHEMBL7848254 0.88 CHRM2 (0.78) CHRM2CHRM1CHRM3
SCHEMBL7840438 0.87 CHRM2 (0.76) CHRM2CHRM1CHRM3
SCHEMBL27503115 0.87 CHRM2 (1.00) CHRM2CHRM1CHRM3
SCHEMBL7467128 0.87 CHRM2 (1.00) CHRM2CHRM1CHRM3
SCHEMBL7841246 0.85 CHRM2 (0.73) CHRM2CHRM1CHRM3
SCHEMBL7840501 0.83 CHRM2 (0.78) CHRM2CHRM1CHRM3

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-0863141-B1 SUBSTITUTED HETEROAROMATIC DERIVATIVES BANYU PHARMA CO LTD (JP) 2001-09-12 — — EP disclosed
US-6130232-A Substituted piperidine derivatives as muscarinic M3 receptor antagonists BANYU PHARMACEUTICAL COALTD (JP) 2000-10-10 — — US disclosed
EP-0863141-A1 SUBSTITUTED HETEROAROMATIC DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-09-09 — — EP disclosed