SCHEMBL159015

SCHEMBL159015

CCCc1nc2c(C)cc(-c3nc4c(C)cccc4[nH]3)cc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGAM O43451 15/20 0.52
GAA P10253 15/20 0.52
SI P14410 15/20 0.52
MGAM2 Q2M2H8 15/20 0.52
ESR1 P03372 1/20 0.47
HPSE Q9Y251 1/20 0.45
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
RPS6KA3 P51812 1/20 0.44

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
Water SCHEMBL3227569 0.99 MGAM (0.51) MGAMGAASIMGAM2ESR1
SCHEMBL1775863 0.86 NPC1 (0.51) GAAKDM4ENPC1ALDH1A1TP53
SCHEMBL1917210 0.85 MGAM (0.47) MGAMGAASIMGAM2ESR1
Water SCHEMBL3220114 0.83 MGAM (0.48) MGAMGAASIMGAM2ESR1
SCHEMBL6456171 0.80 ADORA3 (0.46) KDM4ERPS6KA3
SCHEMBL6755252 0.77 MGAM (0.45) MGAMGAASIMGAM2ESR1
SCHEMBL6753968 0.76 POLB (0.47) MGAMGAASIMGAM2ESR1
SCHEMBL12383063 0.75 PRKCZ (0.44) MGAMGAASIMGAM2KDM4E
SCHEMBL12385419 0.75 MGAM (0.44) MGAMGAASIMGAM2HPGD
SCHEMBL1918450 0.75 KDM4E (0.37) GAAKDM4ENPC1ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445888-A1 PROCESS FOR PREPARING TELMISARTAN INKE, S.A. (ES) 2012-05-02 EP disclosed
WO-2012028925-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF TELMISARTAN OGENE SYSTEMS (I) PVT LTD (IN) 2012-03-08 WO disclosed
WO-2010149565-A1 PROCESS FOR PREPARING TELMISARTAN INKE, S.A. (ES) 2010-12-29 WO disclosed
WO-2009116089-A2 NOVEL INTERMEDIATES AND METHOD FOR SYNTHESIS OF 4'-[(1,4'-DIMETHYL-2'-PROPYL-[2,6'- BI-1HBENZIMIDAZOL]-L-YL)METHYL]-1,1-BIPHENYL]-2-CARBOXYLIC ACID. IPCA LABORATORIES LIMITED (IN) 2009-09-24 WO disclosed
EP-1871764-A1 A SYNTHESIS OF 4-BROMOMETHYL-2'-FORMYLBIPHENYL AND 4-BROMOMETHYL-2'- HYDROXYMETHYLBIPHENYL AND ITS USE IN PREPARATION OF ANGIOTENSIN II ANTAGONISTS LEK Pharmaceuticals D.D. (SI) 2008-01-02 EP disclosed
WO-2006103068-A1 A SYNTHESIS OF 4-BROMOMETHYL-2'-FORMYLBIPHENYL AND 4-BROMOMETHYL-2'- HYDROXYMETHYLBIPHENYL AND ITS USE IN PREPARATION OF ANGIOTENSIN II ANTAGONISTS LEK PHARMACEUTICALS D.D. (SI) 2006-10-05 WO disclosed