SCHEMBL6160817

SCHEMBL6160817

Cc1[nH]c2ccccc2c1CC(NC(=O)C(C)(C)N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 2/20 0.50
GAA P10253 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
ACE P12821 3/20 0.49
OPRM1 P35372 1/20 0.45
GHSR Q92847 1/20 0.45
MME P08473 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
EGFR P00533 2/20 0.44
SRC P12931 2/20 0.44
ALOX15 P16050 2/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
PABPC1 P11940 1/20 0.43
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ITGB2 P05107 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
SCHEMBL6160808 1.00 MAPT (0.50) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL29404786 0.87 GHSR (0.48) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL14979430 0.87 GHSR (0.48) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL8711960 0.84 MAPT (0.56) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL28676764 0.83 ACE (0.52) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL8530675 0.83 ACE (0.52) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL27514965 0.82 ACE (0.42) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL6160724 0.82 ACE (0.46) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL6160719 0.82 ACE (0.46) MAPTALDH1A1KDM4EGAACASP1
SCHEMBL3855556 0.81 MAPT (0.58) MAPTALDH1A1KDM4EGAACASP1

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
CN-1143647-A Dipeptides which promote release of growth hormone PFIZER (US) 1997-02-26 CN disclosed