SCHEMBL11142186

SCHEMBL11142186

CC(CN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.53
▸ CYP2C19 P33261 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ EPHX2 P34913 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ACKR3 P25106 4/20 0.49
▸ DRD2 P14416 1/20 0.48
▸ DRD3 P35462 1/20 0.48
▸ LMNA P02545 1/20 0.47

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
SCHEMBL11137457 0.97 ALDH1A1 (0.49) ALDH1A1CYP2C19SMN1; SMN2EPHX2KMT2A
SCHEMBL11143476 0.95 ALDH1A1 (0.47) ALDH1A1EPHX2KMT2A
SCHEMBL11142321 0.86 CARM1 (0.58) CYP2C19SMN1; SMN2KMT2ALMNA
SCHEMBL11148320 0.86 ADIPOR2 (0.47) ALDH1A1DRD2DRD3
Hydrochloric Acid SCHEMBL11255924 0.85 ADIPOR2 (0.46) ALDH1A1DRD2DRD3
SCHEMBL11141846 0.84 ADIPOR2 (0.50) ALDH1A1CYP2C19SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL11144955 0.84 ADIPOR2 (0.45) ALDH1A1DRD2DRD3
SCHEMBL11142195 0.82 KMT2A (0.44) ALDH1A1CYP2C19SMN1; SMN2EPHX2KMT2A
SCHEMBL11144343 0.82 ADIPOR2 (0.48) ALDH1A1CYP2C19SMN1; SMN2KMT2ADRD2
SCHEMBL11142374 0.81 ADIPOR2 (0.48) ALDH1A1CYP2C19SMN1; SMN2KMT2ADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4339576-A Anti-asthmatic, anti-allergic, anti-cholinergic, bronchodilator and anti-inflammatory 1-[(benzoylphenyl)-lower-alkyl]piperidines and analogs thereof STERLING DRUG INC. (US) 1982-07-13 — — US claimed
EP-0052311-A1 1-((Benzoylphenyl) - lower-alkyl) piperidines and carbinol analogs and preparation thereof STERLING DRUG INC. (US) 1982-05-26 — — EP claimed
US-4396765-A ANTIASTHMATICS, BRONCHODILATORS STERLING DRUG INC. (US) 1983-08-02 — — US disclosed
US-4339576-A Anti-asthmatic, anti-allergic, anti-cholinergic, bronchodilator and anti-inflammatory 1-[(benzoylphenyl)-lower-alkyl]piperidines and analogs thereof STERLING DRUG INC. (US) 1982-07-13 — — US disclosed
EP-0052311-A1 1-((Benzoylphenyl) - lower-alkyl) piperidines and carbinol analogs and preparation thereof STERLING DRUG INC. (US) 1982-05-26 — — EP disclosed
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