SCHEMBL26168212

SCHEMBL26168212

CC(=O)OC1CCB(C#N)C1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.31
▸ DPP8 Q6V1X1 2/20 0.31
▸ DPP9 Q86TI2 2/20 0.31
▸ CHRM2 P08172 2/20 0.30
▸ CHRM4 P08173 2/20 0.30
▸ CHRM5 P08912 2/20 0.30
▸ CHRM1 P11229 2/20 0.30
▸ CHRM3 P20309 2/20 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
SCHEMBL12476221 0.66 CHRM2 (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL177205 0.66 — —
SCHEMBL23486409 0.66 — —
SCHEMBL10620127 0.66 DPP4 (0.36) DPP4DPP8DPP9CHRM2CHRM4
Hydrochloric Acid SCHEMBL28064630 0.64 — —
SCHEMBL28780475 0.64 — —
SCHEMBL27563919 0.64 — —
Ammonia Solution, Strong SCHEMBL28770241 0.64 — —
SCHEMBL21872695 0.63 CHRM2 (0.42) DPP4DPP8DPP9CHRM2CHRM4
SCHEMBL23288610 0.63 TP53 (0.41) —

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-3674307-B1 MACROCYCLE CONTAINING AMINOPYRAZOLE AND PYRIMIDINE AND PHARMACEUTICAL COMPOSITION AND USE THEREOF CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2023-06-07 — — EP disclosed
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