SCHEMBL2933741

SCHEMBL2933741

CC[C@@H]1C[C@@H](O)CN1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.44
RIPK1 Q13546 1/20 0.39
PIK3CD O00329 5/20 0.38
DPP4 P27487 9/20 0.34
DPP8 Q6V1X1 9/20 0.34
DPP9 Q86TI2 9/20 0.34
DPP7 Q9UHL4 1/20 0.33
FAP Q12884 1/20 0.33
ALDH1A1 P00352 1/20 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
SCHEMBL16518661 0.84 ATM (0.53) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL22946712 0.82 CHRNB2 (0.40) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL19577902 0.82 ATM (0.39) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL7657599 0.82 ATM (0.41) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL21801954 0.82 ATM (0.41) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL3316717 0.82 ATM (0.41) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL2993204 0.82 ATM (0.41) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL2563460 0.82 ATM (0.41) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL4303400 0.80 ATM (0.39) ATMRIPK1PIK3CDDPP4DPP8
SCHEMBL376313 0.80 ATM (0.39) ATMRIPK1PIK3CDDPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229356-A1 1,2-DISUBSTITUTED-4-BENZYLAMINO-PYRROLIDINE DERIVATIVES AS CETP INHIBITORS USEFUL FOR THE TREATMENT OF DISEASES SUCH AS HYPERLI PIDEMIA OR ARTERIOSCLEROSIS Novartis AG (CH) 2010-09-22 EP disclosed
WO-2009071509-A1 1,2-DISUBSTITUTED-4-BENZYLAMINO-PYRROLIDINE DERIVATIVES AS CETP INHIBITORS USEFUL FOR THE TREATMENT OF DISEASES SUCH AS HYPERLI PIDEMIA OR ARTERIOSCLEROSIS NOVARTIS AG (CH) 2009-06-11 WO disclosed