SCHEMBL6161407

SCHEMBL6161407

N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)OC(=O)C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRR Q9GZT4 2/20 0.48
PSAT1 Q9Y617 2/20 0.48
ALPI P09923 1/20 0.45
PKM P14618 1/20 0.45
PTGS1 P23219 1/20 0.45
XIAP P98170 1/20 0.45
SLC7A5 Q01650 1/20 0.45
DPP4 P27487 2/20 0.44
PTPN1 P18031 2/20 0.44
PPARG P37231 6/20 0.43
PPARA Q07869 5/20 0.43
GRB2 P62993 1/20 0.43
SLC1A5 Q15758 1/20 0.43
MC4R P32245 1/20 0.42
MC5R P33032 1/20 0.42
MC3R P41968 1/20 0.42
TPH1 P17752 1/20 0.41

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
SCHEMBL3052070 0.91 ALPI (0.54) SRRALPIPKMPTGS1XIAP
SCHEMBL1676744 0.86 MKNK1 (0.45) DPP4
SCHEMBL11401894 0.84 DPP4 (0.44) ALPIPKMPTGS1XIAPSLC7A5
Trifluoroacetic Acid SCHEMBL6161399 0.81 SLC7A5 (0.66) SRRPSAT1ALPIPKMPTGS1
Hydrochloric Acid SCHEMBL31407378 0.81 SRR (0.50) SRRPSAT1ALPIPKMPTGS1
SCHEMBL2720884 0.80 SRR (0.50) SRRPSAT1ALPIPKMPTGS1
SCHEMBL16415824 0.78 CTSK (0.47) SRRPSAT1ALPIPKMPTGS1
SCHEMBL7451018 0.78 SRR (0.54) SRRPSAT1ALPIPKMPTGS1
SCHEMBL539324 0.78 SRR (0.54) SRRPSAT1ALPIPKMPTGS1
SCHEMBL539325 0.78 SRR (0.54) SRRPSAT1ALPIPKMPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
US-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed
WO-1996035713-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER, INC. (US) 1996-11-14 WO disclosed