SCHEMBL286556

SCHEMBL286556

CC(O)c1ccccc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.46
ALDH1A1 P00352 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX15 P16050 1/20 0.41
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
CYP2C9 P11712 2/20 0.39
TSHR P16473 2/20 0.37
FAAH O00519 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
HPGD P15428 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
PTGS1 P23219 1/20 0.37

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
SCHEMBL482545 1.00 HTT (0.46) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL30494040 1.00 HTT (0.46) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL14376099 1.00 HTT (0.46) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL29609183 1.00 HTT (0.46) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL1328402 1.00 HTT (0.46) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL5117680 0.81 IDO1 (0.43) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL11604556 0.81 IDO1 (0.43) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL5117761 0.81 IDO1 (0.43) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL3372946 0.81 IDO1 (0.43) HTTALDH1A1CYP2C19CYP3A4ALOX15
SCHEMBL3375814 0.81 IDO1 (0.43) HTTALDH1A1CYP2C19CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115557836-A Preparation method of carboxylic acid 云南大学 2023-01-03 CN claimed
CN-110002961-B Method for racemization-free synthesis of chiral alcohol 三峡大学 2022-05-03 CN claimed
US-20150045564-A1 Cu-MEDIATED ANNULATION FOR THE EFFECTIVE SYNTHESIS OF 3-SUBSTITUTED PHTHALIDES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-02-12 US claimed
WO-2013102935-A2 Cu-MEDIATED ANNULATION FOR THE EFFECTIVE SYNTHESIS OF 3-SUBSTITUTED PHTHALIDES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-07-11 WO claimed
EP-1542672-A4 R-BAMBUTEROL, ITS PREPARATION AND THERAPEUTIC USES CHENG J L (US) 2006-06-07 EP claimed
US-6989052-B1 Phase change ink printing process XEROX CORPORATION (US) 2006-01-24 US claimed
US-20060004123-A1 PHASE CHANGE INK PRINTING PROCESS XEROX CORPORATION 2006-01-05 US claimed
EP-1542672-A2 R-BAMBUTEROL, ITS PREPARATION AND THERAPEUTIC USES Cheng, J. L. (US) 2005-06-22 EP claimed
WO-2004014290-A2 R-BAMBUTEROL, ITS PREPARATION AND THERAPEUTIC USES CHENG J L (US) 2004-02-19 WO claimed
US-6495243-B1 Recording substrates for ink jet printing XEROX CORPORATION 2002-12-17 US claimed
US-5759734-A Method of generating simulated photographic-quality images on luminescent melt-formed backing substrates XEROX CORPORATION (US) 1998-06-02 US claimed
US-4868344-A OPTICALLY PURE HALOALCOHOLS ALDRICH-BORANES, INC. (US) 1989-09-19 US claimed
US-20250304537-A1 HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME REPARE THERAPEUTICS INC. (CA) 2025-10-02 US disclosed
EP-4526293-A1 HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME Repare Therapeutics Inc. (CA) 2025-03-26 EP disclosed
CN-115160123-B Method for preparing carboxylic acid compound by oxidizing alcohol by using oxygen as oxidant under catalysis of copper 复旦大学 2024-07-30 CN disclosed
US-12043623-B2 Purinones as ubiquitin-specific protease 1 inhibitors FORMA THERAPEUTICS, INC. (US) 2024-07-23 US disclosed
US-4904409-A LIQUID CRYSTAL HAS HIGH TWISTABILITY CHISSO CORPORATION (JP) 1990-02-27 US disclosed
EP-0311329-A2 Liquid crystal compositions comprising optically active 1-[2-halogen-substituted-phenyl]-ethanols and derivatives thereof Chisso Corporation (JP) 1989-04-12 EP disclosed
US-3980722-A Production of bromostyrene, dibromostyrene and alkyl bromides YEDA RESEARCH & DEVELOPMENT CO. LTD. (IL) 1976-09-14 US disclosed
US-3966831-A Production of bromostyrenes YEDA RESEARCH & DEVELOPMENT CO. LTD. (IL) 1976-06-29 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 (3 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-20250304537-A1 HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME CSNK1A1, CSNK1G1, CSNK2A1 HTT 1086/4885ALDH1A1 4490/4885CYP2C19 2763/4885
US-20150045564-A1 Cu-MEDIATED ANNULATION FOR THE EFFECTIVE SYNTHESIS OF 3-SUBSTITUTED PHTHALIDES SOD1, AOC2, SOD3 HTT 669/4885ALDH1A1 97/4885CYP2C19 281/4885
US-12043623-B2 Purinones as ubiquitin-specific protease 1 inhibitors USP1, UBA1, UBXN1 HTT 2813/4885ALDH1A1 633/4885CYP2C19 2166/4885

“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.