SCHEMBL263612

SCHEMBL263612

ClOB(OCl)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 3/20 0.52
ORAI2 Q96SN7 3/20 0.52
ORAI3 Q9BRQ5 3/20 0.52
TRPV6 Q9H1D0 3/20 0.52
CA4 P22748 2/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
ENPP2 Q13822 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
PCSK9 Q8NBP7 1/20 0.41
TSHR P16473 3/20 0.34
ALDH1A1 P00352 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
TRPM2 O94759 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL22578257 0.85 ORAI1 (0.44) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL28243261 0.79 ORAI1 (0.39) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL28054483 0.77 ORAI1 (0.68) ORAI1ORAI2ORAI3TRPV6CA4
Benzene SCHEMBL28042387 0.72 TRPV6 (0.50) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL244920 0.72 TRPV6 (0.50) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL6677524 0.71 ORAI1 (0.46) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL1221793 0.71 TRPV6 (0.46) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL309077 0.71 CA4 (0.48) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL2744416 0.71 ORAI1 (0.46) ORAI1ORAI2ORAI3TRPV6CA4
SCHEMBL28565346 0.71 TRPV6 (0.48) ORAI1ORAI2ORAI3TRPV6CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114736414-A Preparation method of hydrophilic polystyrene microspheres 南京亘闪生物科技有限公司 2022-07-12 CN claimed
CN-111171721-A Ceramizable ablation-resistant coating and preparation method thereof 西安近代化学研究所 2020-05-19 CN claimed
US-8921299-B2 Detergents having acceptable color THE PROCTER & GAMBLE COMPANY (US) 2014-12-30 US claimed
US-20240247382-A1 Surrogate Electrolyzers Producing Hydrogen and an Arbitrage of Urea, Formamide, Ammonia and Methanol PAPILE CHRISTOPHER (US) 2024-07-25 US disclosed
WO-2024126697-A1 HIGH STRENGTH LIQUID PROTEASE FORMULATIONS NOVOZYMES A/S (DK) 2024-06-20 WO disclosed
EP-4379029-A1 POLYPEPTIDES AND COMPOSITIONS COMPRISING SUCH POLYPEPTIDES Novozymes A/S (DK) 2024-06-05 EP disclosed
EP-3647398-B1 CLEANING COMPOSITIONS CONTAINING DISPERSINS V HENKEL AG & CO KGAA (DE) 2024-05-15 EP disclosed
US-20240132808-A1 Storage-Stable Hydrolase Containing Liquids BASF SE (DE) 2024-04-25 US disclosed
CN-117904083-A Protease variants and polynucleotides encoding same 诺维信公司 2024-04-19 CN disclosed
EP-4305146-A1 POLYPEPTIDE VARIANTS Novozymes A/S (DK) 2024-01-17 EP disclosed
US-20240010955-A1 Polypeptides and Compositions Comprising Such Polypeptides NOVOZYMES A/S (DK) 2024-01-11 US disclosed
US-6608063-B2 For example: (2-(3-amino-4-nitrophenyl)amino)ethyl)(6-(2,4-dichlorophenyl-5-nitropyrazin -2-yl)-amine; antidiabetic, -carcingenic and ischemic agents; nervous and cardiovascular system disorders; immunotherapy; obesity; syndromes CHIRON CORPORATION 2003-08-19 US disclosed
WO-2003045924-A1 SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-06-05 WO disclosed
WO-2003009689-A1 METHODS AND COMPOSITIONS FOR TREATING FUNGAL INFECTIONS RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2003-02-06 WO disclosed
EP-1237880-A2 PYRAZINE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2002-09-11 EP disclosed
WO-2001044206-A9 PYRAZINE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORP (US) 2002-05-23 WO disclosed
US-20010034051-A1 Pyrazine based inhibitors of glycogen synthase kinase 3 CHIRON CORPORATION 2001-10-25 US disclosed
WO-2001044206-A1 PYRAZINE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2001-06-21 WO disclosed
WO-1995005081-A1 BIOCIDAL COMPOSITIONS CONTAINING ORGANOBORON COMPOUNDS U.S. BORAX INC. (US) 1995-02-23 WO disclosed
EP-0478050-A1 Detergent composition UNILEVER N.V. (NL) 1992-04-01 EP 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-20010034051-A1 Pyrazine based inhibitors of glycogen synthase kinase 3 GSK3B, GSK3A, GSKIP ORAI1 3065/4885ORAI2 3046/4885ORAI3 1564/4885

“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.