SCHEMBL149337

SCHEMBL149337

[S]c1ccc(-c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.60
TAAR1 Q96RJ0 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MAPK1 P28482 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MMP3 P08254 1/20 0.50
BCL2L1 Q07817 1/20 0.50
ALOX5 P09917 1/20 0.48
CA1 P00915 2/20 0.43
MGLL Q99685 2/20 0.43
MAOA P21397 1/20 0.43
CA2 P00918 1/20 0.43
KIF11 P52732 1/20 0.43
MEN1 O00255 3/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 2/20 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
SCHEMBL997121 1.00 ALDH1A1 (0.60) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
SCHEMBL8511695 0.86 ESR1 (0.39) ALDH1A1CYP3A4TDP1ALOX5MEN1
Biphenyl SCHEMBL27759503 0.82 ALDH1A1 (0.75) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
SCHEMBL18674172 0.82 ALDH1A1 (0.90) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
SCHEMBL827097 0.82 ALDH1A1 (0.90) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
Biphenyl SCHEMBL895675 0.82 ALDH1A1 (0.90) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
Tannin Pyrogallol SCHEMBL21448 0.82 ALDH1A1 (0.90) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
SCHEMBL143471 0.82 ALDH1A1 (0.90) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
SCHEMBL2637802 0.82 ALDH1A1 (0.90) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2
SCHEMBL1991754 0.82 ALDH1A1 (0.90) ALDH1A1TAAR1HSD17B10MAPK1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 disclosed
EP-2478981-B1 SILVER-(CONJUGATED COMPOUND) COMPLEX SUMITOMO CHEMICAL CO (JP) 2020-12-23 EP disclosed
US-9704612-B2 Composition of silver-conjugated compound composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-11 US disclosed
EP-2298737-B1 Indole compounds and organic light-emitting device including the same SAMSUNG DISPLAY CO LTD (KR) 2017-05-10 EP disclosed
EP-2266958-B1 Antiviral agent SHIONOGI & CO (JP) 2017-03-15 EP disclosed
US-20170066754-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2017-03-09 US disclosed
US-9572813-B2 Antiviral agent SHIONOGI & CO., LTD. (JP) 2017-02-21 US disclosed
US-9412487-B2 Silver-(conjugated compound) composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-09 US disclosed
EP-3042894-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2016-07-13 EP disclosed
EP-1025081-A1 S-(4-BIPHENYL)-THIOSULPHURIC ACIDS AND THEIR SALTS, METHOD FOR PRODUCING THE SAME AND METHOD FOR PRODUCING 4-MERCAPTOBIPHENYLS BAYER AG (DE) 2000-08-09 EP disclosed
CN-1219927-A Phenylalkylcarboxylic acid derivatives SANKYO CO (JP) 1999-06-16 CN disclosed
EP-0916651-A1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 1999-05-19 EP disclosed
WO-1999020604-A1 S-(4-BIPHENYL)-THIOSULPHURIC ACIDS AND THEIR SALTS, METHOD FOR PRODUCING THE SAME AND METHOD FOR PRODUCING 4-MERCAPTOBIPHENYLS BAYER AKTIENGESELLSCHAFT (DE) 1999-04-29 WO disclosed
EP-0059036-B1 PLEOCHROIC ANTHRAQUINONE DYES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-07-29 EP disclosed
EP-0142617-A1 Pleochroic anthraquinone dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-05-29 EP disclosed
US-4464282-A ANTHRAQUINONE PLEOCHROIC DYE FOR LIQUID CRYSTALS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITIAN AND NORTHERN IRELAND (GB) 1984-08-07 US disclosed
US-4455253-A FOR LIQUID CRYSTAL DISPLAYS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-06-19 US disclosed
US-4446047-A Pleochroic anthraquinone dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-05-01 US disclosed
EP-0059036-A1 Pleochroic anthraquinone dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-09-01 EP 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-20170066754-A1 ANTIVIRAL AGENT ZC3HAV1, ZC3HAV1L, CCNI ALDH1A1 424/4885TAAR1 3797/4885HSD17B10 1765/4885

“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.