SCHEMBL94499

SCHEMBL94499

Sc1ccc(-c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
TAAR1 Q96RJ0 2/20 0.50
CYP1A2 P05177 2/20 0.50
MAPK1 P28482 1/20 0.50
CYP3A4 P08684 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MMP3 P08254 1/20 0.50
BCL2L1 Q07817 1/20 0.50
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
MGLL Q99685 1/20 0.43
KIF11 P52732 1/20 0.43
NOTUM Q6P988 1/20 0.43
ALOX5 P09917 1/20 0.42
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL966905 1.00 ALDH1A1 (0.60) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL12696283 1.00 ALDH1A1 (0.60) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
Biphenyl SCHEMBL28041385 1.00 ALDH1A1 (0.60) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL28039772 0.97 ALDH1A1 (0.56) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL28039803 0.97 ALDH1A1 (0.56) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL27455156 0.97 ALDH1A1 (0.56) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL17415646 0.97 ALDH1A1 (0.56) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
Biphenyl SCHEMBL27571673 0.97 ALDH1A1 (0.64) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL22605873 0.91 ALDH1A1 (0.50) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
Biphenyl SCHEMBL3201728 0.90 ALDH1A1 (0.64) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025132825-A1 1H-IMIDAZO[4,5-C]QUINOLINE METAL-BASED COMPLEXES USEFUL AS MEDICAMENTS FUNDACIÓN DONOSTIA INTERNATIONAL PHYSICS CENTER - DIPC (ES) 2025-06-26 WO claimed
CN-115066288-B Method for coupling ligands to composite materials 默克密理博有限公司 2025-03-11 CN claimed
CN-119534667-A Method for detecting genetic toxin impurity bromoacetic acid 江苏康缘药业股份有限公司 2025-02-28 CN claimed
CN-119375204-A ZIF-8 coated surface plasmon tungsten oxide-based surface enhanced Raman probe and preparation method and application thereof 暨南大学 2025-01-28 CN claimed
CN-118479989-A Perfluoro alkenyl aryl thioether and preparation method thereof 广东电网有限责任公司 2024-08-13 CN claimed
CN-117645540-A Preparation method of chlorophenoxycarboxylate 山东润博生物科技有限公司 2024-03-05 CN claimed
WO-2023190693-A1 RESIN COMPOSITION FOR OPTICAL WAVEGUIDE, DRY FILM FOR OPTICAL WAVEGUIDE, AND OPTICAL WAVEGUIDE パナソニックIPマネジメント株式会社 2023-10-05 WO claimed
US-20230225952-A1 ADDITIVES FOR COLORING AGENTS AND METHODS OF USE THEREOF LIVING PROOF, INC. 2023-07-20 US claimed
CN-114605157-B Photocuring aluminum nitride ceramic slurry and preparation method thereof 广东工业大学 2023-04-18 CN claimed
US-20220410076-A1 METHODS FOR COUPLING A LIGAND TO A COMPOSITE MATERIAL MERCK MILLIPORE LTD. (IE) 2022-12-29 US claimed
US-20030227793-A1 Information storage device, and information storage method and information regeneration method employing the information storage device MITSUBISHI CHEMICAL CORPORATION (JP) 2003-12-11 US claimed
US-20030082101-A1 Accelerators for increasing the rate of formation of free radicals and reactive oxygen species CAVALIER DISCOVERY 2003-05-01 US claimed
WO-2002100478-A9 ACCELERATORS FOR INCREASING THE RATE OF FORMATION OF FREE RADICALS AND REACTIVE OXYGEN SPECIES CAVALIER DISCOVERY (US) 2003-03-27 WO claimed
WO-2002100478-A2 ACCELERATORS FOR INCREASING THE RATE OF FORMATION OF FREE RADICALS AND REACTIVE OXYGEN SPECIES CAVALIER DISCOVERY (US) 2002-12-19 WO claimed
US-6488357-B2 Corrision resistant hydrophobic liquid level control plate for printhead of ink jet printer and process XEROX CORPORATION 2002-12-03 US claimed
US-20020097297-A1 Corrision resistant hydrophobic liquid level control plate for printhead of ink jet printer and process XEROX CORPORATION 2002-07-25 US claimed
EP-1025081-B1 S-(4-BIPHENYL)-THIOSULPHURIC ACIDS AND THEIR SALTS, METHOD FOR PRODUCING THE SAME AND METHOD FOR PRODUCING 4-MERCAPTOBIPHENYLS BAYER AG (DE) 2002-03-13 EP claimed
US-6271415-B1 PREPARATION STARTING FROM S-(4-BIPHENYL)-SULPHINIC ACIDS AND SALTS BAYER AKTIENGESELLSCHAFT (DE) 2001-08-07 US claimed
US-4828712-A METAL CONTAMINANTS IN WATER MAXWELL LABORATORIES, INC. (US) 1989-05-09 US claimed
US-4559166-A COPPER POWDER, RESIN BINDER AND STABILIZER TO IMPROVE OXIDATION AND CORROSION RESISTANCE; COATINGS; NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1985-12-17 US 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 (2 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-20030082101-A1 Accelerators for increasing the rate of formation of free radicals and reactive oxygen species SOD1, SOD3, APEX1 ALDH1A1 1216/4885TAAR1 2516/4885CYP1A2 1787/4885
US-20230225952-A1 ADDITIVES FOR COLORING AGENTS AND METHODS OF USE THEREOF COXFA4L2, TYR, OAT ALDH1A1 100/4885TAAR1 2177/4885CYP1A2 1263/4885

“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.