SCHEMBL5312566

SCHEMBL5312566

Nc1nc(N)c2ccc[c]c2n1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DCPS Q96C86 1/20 0.48
DHFR P00374 7/20 0.36
MAP4K4 O95819 1/20 0.36
PRMT5 O14744 1/20 0.33
PRMT3 O60678 1/20 0.33
CARM1 Q86X55 1/20 0.33
EHMT2 Q96KQ7 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT1 Q99873 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
HPGD P15428 1/20 0.33
NUDT1 P36639 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL4851533 0.72 PI4KA (0.48) MAP4K4ALDH1A1CYP1A2HSD17B10KDM4E
SCHEMBL4843211 0.68 PDPK1 (0.36) DHFRALDH1A1KDM4E
SCHEMBL22116570 0.67 L3MBTL1 (0.34) ALDH1A1CYP1A2KDM4E
SCHEMBL29375878 0.66 DCPS (1.00) DCPSDHFRALDH1A1CYP1A2HPGD
SCHEMBL269636 0.66 DCPS (1.00) DCPSDHFRALDH1A1CYP1A2HPGD
SCHEMBL1069166 0.64 ALDH1A1 (0.35) ALDH1A1
SCHEMBL27509781 0.64 NCF1 (0.48) ALDH1A1HPGDHSD17B10KDM4E
Hydrochloric Acid SCHEMBL6601650 0.64 DCPS (0.95) DCPSDHFRALDH1A1CYP1A2HPGD
SCHEMBL30468763 0.64 DCPS (0.95) DCPSDHFRALDH1A1CYP1A2HPGD
Hydrochloric Acid SCHEMBL27786605 0.64 DCPS (0.95) DCPSDHFRALDH1A1CYP1A2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773817-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2007-04-18 EP disclosed
WO-2006012374-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2006-02-02 WO disclosed