SCHEMBL5199484

SCHEMBL5199484

COc1ccc(NC(=O)N2CCN(Cc3ccc(C)cc3)C(CC(N)=O)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
FAAH O00519 3/20 0.51
POLB P06746 1/20 0.51
PKM P14618 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
PRKAB2 O43741 1/20 0.45
PRKAG1 P54619 1/20 0.45
PRKAA2 P54646 1/20 0.45
PRKAA1 Q13131 1/20 0.45
PRKAG3 Q9UGI9 1/20 0.45
PRKAG2 Q9UGJ0 1/20 0.45
PRKAB1 Q9Y478 1/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
DGAT1 O75907 1/20 0.44
BLM P54132 1/20 0.44
TSHR P16473 1/20 0.43

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
SCHEMBL5193442 0.96 MAPT (0.55) MAPTFAAHSMN1; SMN2PRKAB2PRKAG1
SCHEMBL5194086 0.91 FAAH (0.62) MAPTFAAHSMN1; SMN2KMT2AMEN1
SCHEMBL5210351 0.88 FAAH (0.46) MAPTFAAHKMT2AMEN1
SCHEMBL5191582 0.85 TP53 (0.56) MAPTFAAHPOLBPKMSMN1; SMN2
SCHEMBL5191970 0.81 MAPT (0.49) MAPTPOLBPKMSMN1; SMN2KMT2A
SCHEMBL5192480 0.80 SIGMAR1 (0.48) MAPTPOLBPKMSMN1; SMN2KMT2A
SCHEMBL5192582 0.79 FAAH (0.50) MAPTFAAHPOLBKMT2AMEN1
SCHEMBL5191215 0.79 FAAH (0.60) MAPTFAAHSMN1; SMN2
SCHEMBL5190010 0.78 POLB (0.60) POLBPKMSMN1; SMN2KMT2AMEN1
SCHEMBL5190799 0.77 PDGFRB (0.42) MAPTKMT2AMEN1

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-0968206-B8 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX INC (US) 2007-01-24 EP claimed
EP-0968206-A1 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX LABORATORIES, INC. (US) 2000-01-05 EP claimed
WO-1998037079-A1 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX LABORATORIES, INC. (US) 1998-08-27 WO claimed