SCHEMBL3376281

SCHEMBL3376281

BrCc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
DCUN1D1 Q96GG9 2/20 0.33
DCUN1D2 Q6PH85 1/20 0.33
GP6 Q9HCN6 1/20 0.32
AGTR1 P30556 4/20 0.31
AGTR2 P50052 4/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL29366164 1.00 TRPA1 (0.35) TRPA1ALDH1A1TSHRDCUN1D1DCUN1D2
SCHEMBL6961815 0.88 TDP1 (0.39) DCUN1D1DCUN1D2GP6AGTR1AGTR2
SCHEMBL1773521 0.86 FYN (0.39) TSHRDCUN1D1DCUN1D2AGTR1AGTR2
SCHEMBL6955274 0.85 GP6 (0.34) TSHRDCUN1D1DCUN1D2GP6AGTR1
SCHEMBL6962635 0.84 AKT1 (0.36) DCUN1D1DCUN1D2GP6AGTR1AGTR2
SCHEMBL6955822 0.84 TP53 (0.41) AGTR1AGTR2
SCHEMBL1132111 0.84 TAAR1 (0.43) ALDH1A1
SCHEMBL21034528 0.84 DCUN1D1 (0.33) DCUN1D1DCUN1D2GP6AGTR1AGTR2
SCHEMBL6957576 0.84 GP6 (0.36) GP6AGTR1AGTR2
SCHEMBL8674236 0.84 FOLH1 (0.33) TRPA1ALDH1A1TSHRDCUN1D1DCUN1D2

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113993851-B Valsartan refining method 浙江华海药业股份有限公司 2024-02-09 CN disclosed
WO-2023181045-A1 PROCESS FOR THE PREPARATION OF CARCINOGENIC AZIDO IMPURITIES FREE LOSARTAN AND SALTS THEREOF IOL CHEMICALS AND PHARMACEUTICALS LIMITED (IN) 2023-09-28 WO disclosed
CN-113727976-B Refining method of valsartan compound 浙江华海药业股份有限公司 2023-07-21 CN disclosed
CN-113993851-A Valsartan refining method 浙江华海药业股份有限公司 2022-01-28 CN disclosed
CN-113727976-A Refining method of valsartan compound 浙江华海药业股份有限公司 2021-11-30 CN disclosed
WO-2021022516-A1 VALSARTAN REFINEMENT METHOD 浙江华海药业股份有限公司 2021-02-11 WO disclosed
WO-2020252662-A1 METHOD FOR REFINING VALSARTAN COMPOUND 浙江华海药业股份有限公司 2020-12-24 WO disclosed
EP-2194050-A1 A new process for the preparation of irbesartan KRKA, tovarna zdravil, d.d., Novo mesto (SI) 2010-06-09 EP disclosed
US-20080275096-A1 Process for the preparation of valsartan HAREL ZVI 2008-11-06 US disclosed
US-7378531-B2 Process for the preparation of valsartan TEVA PHARMACEUTICAL INDUSTRIES LTD (IL) 2008-05-27 US disclosed
EP-0711762-B1 PROCESS FOR PRODUCING TETRAZOLE COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2003-08-06 EP disclosed
US-6277998-B1 REACTING 2-CYANO-4-OXO-4H-BENZOPYRAN COMPOUND WITH HYDROGEN SULFIDE AND THEN REACTING PROUDCT WITH ALKYL HALIDE; REACTING THE PRODUCT WITH HYDRAZINE OR ITS SALT AND THEN WITH NITROUS ACID COMPOUND TO OBTAIN TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-21 US disclosed
US-6214999-B1 A BROMINATING AGENT IS REACTED IN A 2 PHASE MEDIUM, UNDER EFFECT PHOTO-IRRADIATION WITH BIPHENYL DERIVATIVE SANOFI-SYNTHELABO (FR) 2001-04-10 US disclosed
US-6191289-B1 REACTING A 4-OXO-4H-BENZOPYRAN GROUP SUBSTITUTED WITH AMIDE OR A PHENYL GROUP IN ITS 2 POSITION IS REACTED WITH ANHYDROUS HYDRAZINE OR SALT IN PRESENCE OF CATALYST FOLLOWED BY REACTING WITH NITROUS ACID OR SALT TO FORM TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-02-20 US disclosed
EP-1032557-A1 METHOD FOR PREPARING BROMOMETHYL-BIPHENYL DERIVATIVES SANOFI-SYNTHELABO (FR) 2000-09-06 EP disclosed
WO-1999025681-A1 METHOD FOR PREPARING BROMOMETHYL-BIPHENYL DERIVATIVES SANOFI-SYNTHELABO (FR) 1999-05-27 WO disclosed
US-5874593-A SULFUR CONTAINING AMIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-23 US disclosed
EP-0711762-A1 PROCESS FOR PRODUCING TETRAZOLE COMPOUND AND INTERMEDIATE THEREFOR SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-05-15 EP disclosed
US-5326776-A Tetrazoles ABBOTT LABORATORIES (US) 1994-07-05 US disclosed
WO-1993017681-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1993-09-16 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 (1 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-20080275096-A1 Process for the preparation of valsartan REN, AGT, AVPR2 TRPA1 4494/4885ALDH1A1 2835/4885TSHR 2455/4885

“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.