SCHEMBL9028457

SCHEMBL9028457

COc1ccc(C(=O)N2CCC(O)C2)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.62
▸ ALDH1A1 P00352 3/20 0.56
▸ POLB P06746 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ LRRK2 Q5S007 1/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ HPGD P15428 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL14068213 0.88 HSD11B1 (0.54) LMNAALDH1A1KDM4ELRRK2
SCHEMBL790385 0.88 LRRK2 (0.60) LMNAALDH1A1KDM4ELRRK2
SCHEMBL15650487 0.88 HSD11B1 (0.54) LMNAALDH1A1KDM4ELRRK2
SCHEMBL15651433 0.88 HSD11B1 (0.54) LMNAALDH1A1KDM4ELRRK2
SCHEMBL19893248 0.80 SPTLC2 (0.59) LMNAALDH1A1POLBCYP2C19MAPK1
SCHEMBL19893251 0.80 SPTLC2 (0.59) LMNAALDH1A1POLBCYP2C19MAPK1
SCHEMBL791202 0.80 LRRK2 (0.47) LMNAALDH1A1KDM4ELRRK2
SCHEMBL15142279 0.80 LMNA (0.51) LMNAALDH1A1POLBCYP2C19MAPK1
SCHEMBL9997035 0.80 KMT2A (0.55) LMNAALDH1A1POLBCYP2C19KDM4E
SCHEMBL15653314 0.80 HSD11B1 (0.59) LMNAALDH1A1POLBCYP2C19KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0486386-B1 Novel derivatives of N-benzoylproline, process for their preparation and drugs containing them ADIR (FR) 1996-07-17 — — EP claimed
EP-0486386-A2 Novel derivatives of N-benzoylproline, process for their preparation and drugs containing them ADIR ET COMPAGNIE (FR) 1992-05-20 — — EP claimed
EP-0486386-B1 Novel derivatives of N-benzoylproline, process for their preparation and drugs containing them ADIR (FR) 1996-07-17 — — EP disclosed
EP-0486386-A2 Novel derivatives of N-benzoylproline, process for their preparation and drugs containing them ADIR ET COMPAGNIE (FR) 1992-05-20 — — EP disclosed
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