SCHEMBL2443650

SCHEMBL2443650

CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)C(C(=O)OC)C(C)C

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 13/20 0.63
▸ LTB4R2 Q9NPC1 6/20 0.53
▸ ABCB11 O95342 1/20 0.53
▸ GP6 Q9HCN6 1/20 0.53
▸ AGT P01019 2/20 0.44
▸ AGTR2 P50052 1/20 0.42

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
SCHEMBL29670077 1.00 AGTR1 (0.63) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL1259493 1.00 AGTR1 (0.63) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL8140438 0.95 AGTR1 (0.56) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL29205122 0.93 AGTR1 (0.54) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL29205124 0.93 AGTR1 (0.54) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL4092523 0.93 AGTR1 (0.59) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL4154512 0.92 AGTR1 (0.53) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL2913 0.92 AGTR1 (0.53) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL12894045 0.92 AGTR1 (0.53) AGTR1LTB4R2ABCB11GP6AGT
SCHEMBL1891052 0.92 AGTR1 (0.62) AGTR1LTB4R2ABCB11GP6AGT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104151199-A Method for synthesizing valsartan SUZHOU HEALTH COLLEGE 2014-11-19 — — CN disclosed
US-8492577-B2 Process for preparation of valsartan intermediate HETERO RESEARCH FOUNDATION (IN) 2013-07-23 — — US disclosed
US-20110237822-A1 PROCESS FOR PREPARATION OF VALSARTAN INTERMEDIATE HETERO RESEARCH FOUNDATION (IN) 2011-09-29 — — US disclosed
US-7880015-B2 treating N-[[2'-(1-triphenylmethyltetrazol-5-yl)biphenyl-4-yl]methyl]-L-valine methyl ester with oxalic acid to produce N-[[2'-(1-triphenylmethyltetrazol-5-yl)biphenyl-4-yl]methyl]-L-valine methyl ester oxalate, treating intermediate with a base and vlaeryl chloride , deprotecting; Valsartan product AUROBINDO PHARMA LTD. (IN) 2011-02-01 — — US disclosed
US-7880015-B2 treating N-[[2'-(1-triphenylmethyltetrazol-5-yl)biphenyl-4-yl]methyl]-L-valine methyl ester with oxalic acid to produce N-[[2'-(1-triphenylmethyltetrazol-5-yl)biphenyl-4-yl]methyl]-L-valine methyl ester oxalate, treating intermediate with a base and vlaeryl chloride , deprotecting; Valsartan product AUROBINDO PHARMA LTD. (IN) 2011-02-01 — — US disclosed
EP-2260018-A2 PROCESS FOR PREPARATION OF VALSARTAN INTERMEDIATE Hetero Research Foundation (IN) 2010-12-15 — — EP disclosed
US-20090281326-A1 Process For the Preparation of Angiotensin II Antagonist AUROBINDO PHARMA LTD (IN) 2009-11-12 — — US disclosed
US-20090281326-A1 Process For the Preparation of Angiotensin II Antagonist AUROBINDO PHARMA LTD (IN) 2009-11-12 — — US disclosed
WO-2009125416-A2 PROCESS FOR PREPARATION OF VALSARTAN INTERMEDIATE HETERO RESEARCH FOUNDATION (IN) 2009-10-15 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090281326-A1 Process For the Preparation of Angiotensin II Antagonist REN, VCL, PTMS AGTR1 7/4885LTB4R2 1367/4885ABCB11 493/4885
US-20110237822-A1 PROCESS FOR PREPARATION OF VALSARTAN INTERMEDIATE REN, AGT, ACE AGTR1 6/4885LTB4R2 2598/4885ABCB11 414/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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