SCHEMBL5840950

SCHEMBL5840950

Brc1nc2ccccc2c(Br)c1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.44
ALDH1A1 P00352 5/20 0.44
HPGD P15428 4/20 0.44
GLA P06280 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
HSD17B10 Q99714 3/20 0.44
MAOA P21397 2/20 0.44
CASP1 P29466 2/20 0.44
CASP7 P55210 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CHRM2 P08172 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
NQO2 P16083 1/20 0.44
DRD1 P21728 1/20 0.44
ACHE P22303 1/20 0.44
SLC6A2 P23975 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRM1 P35372 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
SCHEMBL2512737 0.82 KDM4E (0.56) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL4027568 0.80 TDP1 (0.47) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL15491314 0.80 POLB (0.41) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL8205763 0.78 GPR3 (0.54) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL5049954 0.77 POLB (0.42) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL15491313 0.76 POLB (0.60) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL9364466 0.76 ERN1 (0.51) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL1128076 0.73 MAPT (0.62) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL29948882 0.73 MAPT (0.62) KDM4EALDH1A1HPGDGLATDP1
SCHEMBL28219986 0.73 MAOA (0.64) KDM4EALDH1A1HPGDGLATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111925289-A Preparation method of 5-bromo-2-chlorobenzoic acid 浙江美诺华药物化学有限公司 2020-11-13 CN claimed
CN-115443436-A Laminated film for pattern formation, non-photosensitive screen printing plate, and method for producing same 株式会社村上 2022-12-06 CN disclosed
EP-1553449-B1 ACTIVE ENERGY RAY SENSITIVE RESIN COMPOSITION, ACTIVE ENERGY RAY SENSITIVE RESIN FILM AND METHOD FOR FORMING PATTERN USING SAID FILM MURAKAMI CO LTD (JP) 2016-01-20 EP disclosed
CN-102766091-A Preparation method of 3-(3-quinolyl)-2-propyne-1-alcohol SHANGHAI INST PHARM INDUSTRY 2012-11-07 CN disclosed
US-7009055-B2 such as (methyl-sulfonyl)methyl bromo-quinoline by treatment of dibromomethyl bromo-quinoline with sodium methanesulfinate in solvent; chemical intermediates in production of phosphodiesterase inhibitors MERCK & CO., INC. (US) 2006-03-07 US disclosed
US-20050227166-A1 Active energy ray sensitive resin composition, active energy ray sensitive resin film and method for forming pattern using said film MURAKAMI CO., LTD. (JP) 2005-10-13 US disclosed
EP-1553449-A1 ACTIVE ENERGY RAY SENSITIVE RESIN COMPOSITION, ACTIVE ENERGY RAY SENSITIVE RESIN FILM AND METHOD FOR FORMING PATTERN USING SAID FILM Murakami Co., Ltd. (JP) 2005-07-13 EP disclosed
US-20040176604-A1 Preparation of sulfonyl quinoline XU FENG (US) 2004-09-09 US disclosed
WO-2003010137-A1 PREPARATION OF SULFONYL QUINOLINE MERCK & CO., INC. (US) 2003-02-06 WO disclosed
US-5145760-A POSITIVE-WORKING PHOTOSENSITIVE ELECTROSTATIC MASTER WITH IMPROVED INVIRONMENTAL LATITUDE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-09-08 US 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-20040176604-A1 Preparation of sulfonyl quinoline STS, SULT2A1, BRD7 KDM4E 1298/4885ALDH1A1 2511/4885HPGD 4271/4885

“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.