SCHEMBL244920

SCHEMBL244920

OB(OCl)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV6 Q9H1D0 4/20 0.50
ENPP2 Q13822 4/20 0.50
ORAI1 Q96D31 3/20 0.50
ORAI2 Q96SN7 3/20 0.50
ORAI3 Q9BRQ5 3/20 0.50
PCSK9 Q8NBP7 2/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
CA1 P00915 5/20 0.38
CA2 P00918 4/20 0.38
MGLL Q99685 2/20 0.38
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
TRPM2 O94759 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
Benzene SCHEMBL28042387 1.00 TRPV6 (0.50) TRPV6ENPP2ORAI1ORAI2ORAI3
SCHEMBL29658033 0.81 MGLL (0.62) TRPV6ENPP2ORAI1ORAI2ORAI3
SCHEMBL2436493 0.81 MGLL (0.47) TRPV6ENPP2ORAI1ORAI2ORAI3
Trifluoromethylbenzene SCHEMBL28023606 0.80 TRPV6 (0.51) TRPV6ENPP2ORAI1ORAI2ORAI3
SCHEMBL1848691 0.78 TRPV6 (0.63) TRPV6ENPP2ORAI1ORAI2ORAI3
SCHEMBL20595738 0.77 CA1 (0.61) ENPP2CA7CA14CA1CA2
SCHEMBL28718291 0.76 TRPV6 (0.52) TRPV6ENPP2ORAI1ORAI2ORAI3
SCHEMBL263598 0.76 TRPV6 (0.52) TRPV6ENPP2ORAI1ORAI2ORAI3
SCHEMBL2316506 0.75 ORAI1 (0.54) TRPV6ENPP2ORAI1ORAI2ORAI3
SCHEMBL28029418 0.75 CYP19A1 (0.34) MEN1ALDH1A1CYP1A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850021-A Preparation method of polychlorinated biphenyl standard substance 上海安谱实验科技股份有限公司 2023-03-28 CN claimed
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-110128460-A A kind of siliceous electroluminescent organic material and preparation method thereof 黑龙江省科学院石油化学研究院 2019-08-16 CN claimed
CN-106632070-B A kind of preparation method of PDE4 inhibitor chlorine than Pulan 广州兰晟健智医药科技有限公司 2019-08-06 CN claimed
CN-110054642-A A kind of preparation method of pair of chlorophenylboronic acid 京博农化科技有限公司 2019-07-26 CN claimed
CN-109912425-A A kind of preparation method of the chloro- 2 nitro biphenyl of 4`- 京博农化科技有限公司 2019-06-21 CN claimed
CN-107400079-B A kind of Regioselective synthesis of 2,5- disubstituted pyrroles 大连理工大学 2019-05-10 CN claimed
CN-109680342-A The method that On-DNA virtue nitro compound is reduced into On-DNA aromatic amine compound in DNA encoding compound library 上海药明康德新药开发有限公司 2019-04-26 CN claimed
CN-106674083-B A kind of photoelectric material intermediate 9-(4 '-chlordiphenyl -2- base) carbazole synthetic method 濮阳惠成电子材料股份有限公司 2019-03-26 CN claimed
CN-106631812-B A kind of Boscalid intermediate 4 '-chloro- 2- nitro -1,1 '-biphenyl preparation method 浙江工业大学 2019-03-05 CN claimed
CN-104785301-A Magnetic palladium composite catalyst, and preparation method and use thereof SUZHOU TOKIND CHEMICAL CO LTD 2015-07-22 CN claimed
CN-103539679-B Method for preparing 4'-chloro-2-aminobiphenyl through palladium/carbon catalysis JUNKAI TIANJIN CHEMICAL CO LTD 2015-05-13 CN claimed
CN-104529794-A Method for preparing boscalid intermediate 2-(4-chlorophenyl) aniline JINGBO AGROCHEMICALS TECHNOLOGY CO LTD 2015-04-22 CN claimed
CN-104478797-A Preparation method of nicotinamide fungicide namely boscalid SUZHOU TOKIND CHEMICAL CO LTD 2015-04-01 CN claimed
CN-104478725-A Method for preparing 4'-chloro-2-nitro biphenyl JUNKAI TIANJIN CHEMICAL CO LTD 2015-04-01 CN claimed
US-8110642-B2 Synthesis of vinylphenylpyridine and living anionic polymerization GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-02-07 US claimed
CN-101157590-B Method for preparing alpha-aryl carbonyl compound UNIV WUHAN 2010-06-02 CN claimed
US-20090105416-A1 Synthesis of Vinylphenylpyridine and Living Anionic Polymerization GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-04-23 US claimed
CN-101157590-A Method for preparing alpha-aryl carbonyl compound UNIV WUHAN (CN) 2008-04-09 CN claimed
WO-2007129810-A1 SYNTHESIS OF VINYLPHENYLPYRIDINE AND LIVING ANIONIC POLYMERIZATION GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2007-11-15 WO claimed

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-20090105416-A1 Synthesis of Vinylphenylpyridine and Living Anionic Polymerization PBRM1, MVD, PCBP1 TRPV6 90/4885ENPP2 3153/4885ORAI1 620/4885

“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.