SCHEMBL8093317

SCHEMBL8093317

CC(C(=O)O)[C@H](NCc1ccccc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
SIGMAR1 Q99720 1/20 0.52
KMT2A Q03164 2/20 0.49
POLB P06746 1/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
MEP1B Q16820 2/20 0.46
ACP3 P15309 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
ITGB3 P05106 1/20 0.44
ITGB1 P05556 1/20 0.44
ITGAV P06756 1/20 0.44
ITGA5 P08648 1/20 0.44

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
Acetic Acid SCHEMBL27312500 0.96 ALDH1A1 (0.51) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL29060375 0.89 ALDH1A1 (0.62) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL8065362 0.89 ALDH1A1 (0.62) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL8349459 0.89 ALDH1A1 (0.62) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL27853244 0.88 ALDH1A1 (0.51) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL5085491 0.88 ALDH1A1 (0.51) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL5087907 0.88 ALDH1A1 (0.51) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL7599136 0.87 ALDH1A1 (0.53) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL7876545 0.87 ALDH1A1 (0.53) ALDH1A1SIGMAR1KMT2APOLBMEN1
SCHEMBL31336702 0.87 ALDH1A1 (0.53) ALDH1A1SIGMAR1KMT2APOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1123544-A Optically active 3-(1-(alkylamino)) alkyl pyrrolidines UPJOHN CO (US) 1996-05-29 CN claimed
EP-0697015-A1 OPTICALLY ACTIVE 3-(1-(ALKYLAMINO))ALKYL PYRROLIDINES PHARMACIA & UPJOHN COMPANY (US) 1996-02-21 EP claimed
WO-1994026708-A1 OPTICALLY ACTIVE 3-(1-(ALKYLAMINO))ALKYL PYRROLIDINES THE UPJOHN COMPANY (US) 1994-11-24 WO claimed
US-6140510-A Optically active 3-(1-(carbamoyl))alkyl-2-oxo-pyrrolidines and optically active 3-(1-(alkylamido))alkyl-2-oxo-pyrrolidines PHARMACIA & UPJOHN COMPANY (US) 2000-10-31 US disclosed
US-5962697-A Optically active 3-(1-(alkylamino))alkyl pyrrolidines PHARMACIA & UPJOHN COMPANY (US) 1999-10-05 US disclosed
US-5773610-A Optically active 3-(1-(alkylamino))alkyl pyrrolidines PHARMACIA & UPJOHN COMPANY (US) 1998-06-30 US disclosed
CN-1123544-A Optically active 3-(1-(alkylamino)) alkyl pyrrolidines UPJOHN CO (US) 1996-05-29 CN disclosed
EP-0697015-A1 OPTICALLY ACTIVE 3-(1-(ALKYLAMINO))ALKYL PYRROLIDINES PHARMACIA & UPJOHN COMPANY (US) 1996-02-21 EP disclosed
WO-1994026708-A1 OPTICALLY ACTIVE 3-(1-(ALKYLAMINO))ALKYL PYRROLIDINES THE UPJOHN COMPANY (US) 1994-11-24 WO disclosed