SCHEMBL6204550

SCHEMBL6204550

C=CC[CH]c1ccc(C(=N)N)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.57
PRMT1 Q99873 1/20 0.57
ALDH1A1 P00352 1/20 0.57
HPGD P15428 1/20 0.57
CYP2C19 P33261 1/20 0.57
HSD17B10 Q99714 1/20 0.57
F10 P00742 5/20 0.45
PRSS1 P07477 5/20 0.45
PRSS3 P35030 2/20 0.45
LOXL2 Q9Y4K0 1/20 0.45
PRSS2 P07478 1/20 0.45
PLAU P00749 3/20 0.45
LMNA P02545 2/20 0.45
MASP2 O00187 1/20 0.45
THPO P40225 1/20 0.45
F2 P00734 6/20 0.43
APEX1 P27695 1/20 0.43
ST14 Q9Y5Y6 1/20 0.42
F12 P00748 1/20 0.41
F7 P08709 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
SCHEMBL6207335 0.79 PRMT5 (0.61) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL1244509 0.79 ALDH1A1 (0.67) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL1468321 0.78 PRMT5 (0.59) PRMT5PRMT1ALDH1A1HPGDCYP2C19
Hydrochloric Acid SCHEMBL29182256 0.77 ALDH1A1 (0.64) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL5456054 0.74 ALDH1A1 (0.67) PRMT5PRMT1ALDH1A1HPGDCYP2C19
Hydrochloric Acid SCHEMBL9280078 0.73 PRSS1 (0.57) PRMT5PRMT1ALDH1A1HPGDCYP2C19
Bromide SCHEMBL11499076 0.73 PRSS1 (0.57) PRMT5PRMT1ALDH1A1HPGDCYP2C19
Stilbamidine SCHEMBL889782 0.73 PRMT1 (1.00) PRMT5PRMT1ALDH1A1HPGDCYP2C19
Stilbamidine SCHEMBL208655 0.73 PRMT1 (1.00) PRMT5PRMT1ALDH1A1HPGDCYP2C19
SCHEMBL6204477 0.73 F2 (0.54) PRMT5PRMT1ALDH1A1HPGDCYP2C19

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-1539762-A2 BICYCLIC PYRIMIDINONES AS COAGULATION CASCADE INHIBITORS Bristol-Myers Squibb Company (US) 2005-06-15 EP disclosed
WO-2004002406-A2 BICYCLIC PYRIMIDINONES AS COAGULATION CASCADE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-01-08 WO disclosed