SCHEMBL5771336

SCHEMBL5771336

C=C(c1ccc(Cl)c(Cl)c1Cl)N1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.44
USP2 O75604 1/20 0.44
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
GLA P06280 1/20 0.36

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
SCHEMBL4965838 0.76 KMT2A (0.47) HPGDKMT2AMEN1LMNANPC1
SCHEMBL18544668 0.74 LMNA (0.50) HPGDKMT2AMEN1LMNASMN1; SMN2
SCHEMBL4574791 0.74 MEN1 (0.45) HPGDUSP2KMT2AMEN1NPC1
SCHEMBL4574595 0.70 LMNA (0.46) HPGDKMT2AMEN1LMNASMN1; SMN2
SCHEMBL19036565 0.67 CYP3A4 (0.42) KMT2AGLA
SCHEMBL9824663 0.67 CLCN2 (0.45) KMT2AMEN1LMNA
SCHEMBL4574011 0.67 SMN1; SMN2 (0.50) HPGDKMT2AMEN1LMNASMN1; SMN2
SCHEMBL7182897 0.66 HPGD (0.50) HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL1943292 0.66 RAB9A (0.51) HPGDKMT2AMEN1LMNASMN1; SMN2
SCHEMBL23021674 0.64 HPGD (0.61) HPGDUSP2KMT2AMEN1LMNA

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-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