SCHEMBL5774019

SCHEMBL5774019

CCOC(=O)c1[nH]c(-c2ccc(F)cc2)cc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
NPC1 O15118 4/20 0.54
RAB9A P51151 4/20 0.54
KDM4E B2RXH2 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
GCGR P47871 1/20 0.51
MAPK14 Q16539 1/20 0.51
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49
GRM6 O15303 1/20 0.48
PRKCZ Q05513 1/20 0.48
HPGD P15428 2/20 0.47
MAPK1 P28482 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
TSHR P16473 1/20 0.47
ALDH1A1 P00352 2/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL2748256 0.88 LMNA (0.54) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL21264058 0.86 MAPT (0.54) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL5771002 0.86 GCGR (0.55) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL5775657 0.86 ALDH1A1 (0.52) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL2748270 0.85 HPGD (0.56) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL10397352 0.85 MAPK14 (0.61) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL5772136 0.85 POLB (0.44) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL5771719 0.82 SLC6A2 (0.48) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL5773315 0.81 ALDH1A1 (0.50) MAPTNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL18342044 0.81 MEN1 (0.55) MAPTNPC1RAB9AKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054887-B1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC (US) 2006-04-12 EP disclosed
US-6583154-B1 Neuropeptide Y antagonist; pyrrolo-(3,2-b)pyridines and pyrrolo-(3,2-d)pyrimidines AMGEN INC. 2003-06-24 US disclosed
US-6187777-B1 PYRROLO(3,2-D)PYRIMIDINE DERIVATIVES; NEUROPEPTIDE Y AND CORTICOTROPIN RELEASING FACTOR MODULATORS; DIETETICS; ANTIDIABETIC, ANTIINFLAMMATORY, AND ANTITUMOR AGENTS AMGEN INC. 2001-02-13 US disclosed
EP-1054887-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Amgen Inc. (US) 2000-11-29 EP disclosed
WO-1999040091-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC. (US) 1999-08-12 WO disclosed