SCHEMBL905392

SCHEMBL905392

ClCc1ccc2ccccc2c1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.60
CYP1A2 P05177 2/20 0.60
KMT2A Q03164 1/20 0.52
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
MC4R P32245 2/20 0.47
MC5R P33032 2/20 0.47
SIGMAR1 Q99720 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
MC3R P41968 1/20 0.44
ALOX5 P09917 1/20 0.44
CTRC Q99895 1/20 0.43

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
SCHEMBL31355436 1.00 CYP2A6 (0.60) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL29418999 1.00 CYP2A6 (0.60) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL4574912 0.93 CYP2A6 (0.52) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL30872875 0.89 CYP1A2 (0.44) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL5885608 0.89 CYP1A2 (0.44) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL30443467 0.87 CYP1A2 (0.42) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL1338429 0.87 CYP1A2 (0.42) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL30443328 0.84 CYP1A2 (0.41) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL5885438 0.84 CYP1A2 (0.41) CYP2A6CYP1A2KMT2AHTR2AHTR2C
SCHEMBL6484091 0.82 ESR1 (0.55) CYP2A6CYP1A2KMT2AHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850002-B Method for hydrodehalogenating halogenated alkane 中国科学院兰州化学物理研究所 2025-05-23 CN claimed
CN-115959962-B Visible light-promoted halogenated alkane hydrodehalogenation method 中国科学院兰州化学物理研究所 2025-05-23 CN claimed
WO-2025090396-A1 SYSTEMS AND METHODS OF MEASURING SULFUR COMPOSITION IN A GAS AND LIQUIFIED GAS SAUDI ARABIAN OIL COMPANY (SA) 2025-05-01 WO claimed
US-20250137981-A1 SYSTEMS AND METHODS OF MEASURING SULFUR COMPOSITION IN A GAS AND LIQUIFIED GAS SAUDI ARABIAN OIL COMPANY (SA) 2025-05-01 US claimed
CN-112771684-B Ink composition for manufacturing organic semiconductor device 株式会社大赛璐 2024-07-12 CN claimed
CN-117843824-A Synthesis method of achyranthes bidentata polysaccharide ABW90-1 and/or ABW50-1 中国科学院昆明植物研究所 2024-04-09 CN claimed
CN-117024298-A Tertiary amide compound containing naphthyl and its preparation method and application 北京中医药大学 2023-11-10 CN claimed
CN-110982508-B Mannich base acidizing corrosion inhibitor and preparation method thereof 西南石油大学 2022-03-08 CN claimed
CN-110982508-A Mannich base acidizing corrosion inhibitor and preparation method thereof 西南石油大学 2020-04-10 CN claimed
CN-104844744-B A kind of resin to cephalosporin with specific adsorption and preparation method thereof 艾美科健(中国)生物医药有限公司 2017-11-28 CN claimed
CN-106350056-A Corrosion inhibitor applicable to crosslinked acid acidification at 120-140 DEG C and preparation method of corrosion inhibitor applicable to crosslinked acid acidification at 120-140 DEG C 中国石油集团渤海钻探工程有限公司 2017-01-25 CN claimed
CN-104844744-A Resin with specific adsorption for cephalosporin C and preparation method therefor SHANDONG LUKANG RECORD PHARMACEUTICALS CO LTD 2015-08-19 CN claimed
CN-104447515-A New intermediates for preparing ceritinib and preparation method of intermediate 2Y CHEM LTD 2015-03-25 CN claimed
CN-103288668-A Fluorescent dihydric alcohol with symmetrical structure and preparation method thereof USTC UNIV SCIENCE TECH CN 2013-09-11 CN claimed
CN-101597210-B Method for separating and purifying 1-chloromethyl naphthalene SHANGHAI BAOSTEEL CHEMICAL CO 2012-11-14 CN claimed
CN-101481360-A Sulfur-bearing photo-curing compound and preparation thereof UNIV ZHONGSHAN (CN) 2009-07-15 CN claimed
EP-0028921-A1 Alkylation of sulfones UNIROYAL, INC. (US) 1981-05-20 EP claimed
US-4152352-A PRODUCTION OF ARYLPYRUVIC ACIDS RHONE-POULENC INDUSTRIES (FR) 1979-05-01 US claimed
EP-4582596-A1 PLATING SOLUTION JCU Corporation (JP) 2025-07-09 EP disclosed
US-3919230-A {62 -Naphthylmethyl piperazinyl derivatives SMITHKLINE BECKMAN CORPORATION 1975-11-11 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-20250137981-A1 SYSTEMS AND METHODS OF MEASURING SULFUR COMPOSITION IN A GAS AND LIQUIFIED GAS TST, GSS, SQOR CYP2A6 590/4885CYP1A2 906/4885KMT2A 3987/4885

“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.