Questiomycin B

Questiomycin B

SCHEMBL454283

CCOCC.Nc1ccccc1O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 5/20 0.65
▸ TSHR P16473 3/20 0.65
▸ ALDH1A1 P00352 7/20 0.47
▸ HSD17B10 Q99714 6/20 0.44
▸ CA2 P00918 3/20 0.39
▸ CA12 O43570 2/20 0.39
▸ CA14 Q9ULX7 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA7 P43166 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ HPGD P15428 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 2/20 0.38

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
Questiomycin B SCHEMBL11671248 1.00 ALOX15 (0.65) ALOX15TSHRALDH1A1HSD17B10CA2
Questiomycin B SCHEMBL2411821 0.94 ALOX15 (0.58) ALOX15TSHRALDH1A1HSD17B10CA2
Questiomycin B SCHEMBL8718526 0.86 ALOX15 (0.79) ALOX15TSHRALDH1A1HSD17B10CA2
Questiomycin B SCHEMBL10786495 0.84 ALOX15 (0.75) ALOX15TSHRALDH1A1HSD17B10CA2
Questiomycin B SCHEMBL27305569 0.84 ALOX15 (0.75) ALOX15TSHRALDH1A1HSD17B10CA2
Catechol SCHEMBL5431374 0.84 CA2 (0.56) ALOX15TSHRALDH1A1HSD17B10CA2
Ether SCHEMBL28632893 0.84 ALDH1A1 (0.56) ALOX15TSHRALDH1A1HSD17B10CYP1A2
Catechol SCHEMBL27085 0.84 CA2 (0.56) ALOX15TSHRALDH1A1HSD17B10CA2
Ether SCHEMBL6065896 0.83 TSHR (0.43) ALOX15TSHRALDH1A1HSD17B10CA2
Questiomycin B SCHEMBL27521296 0.81 ALOX15 (0.88) ALOX15TSHRALDH1A1HSD17B10CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111171246-A Amphoteric polycarboxylic acid water reducing agent and preparation method thereof 马清浩 2020-05-19 — — CN claimed
EP-2961739-A2 FURFURAL DERIVATIVES AS A VEHICLE Rhodia Operations (FR) 2016-01-06 — — EP claimed
WO-2014132178-A2 FURFURAL DERIVATIVES AS A VEHICLE RHODIA OPERATIONS (FR) 2014-09-04 — — WO claimed
US-20080171765-A1 Aniline or phenol mustards linked to DNA-affinic molecules or water-soluble aromatic rings and their use as cancer therapeutic agents ACADEMIA SINICA (TW) 2008-07-17 — — US claimed
US-4231963-A ETHERIFICATION OF ALKALI METAL AMINOPHENOLATE IHARA CHEMICAL INDUSTRY COMPANY, LIMITED (JP) 1980-11-04 — — US claimed
US-4125717-A NITROSATION OF AMINOPHENOL ETHERS BAYER AKTIENGESELLSCHAFT (DE) 1978-11-14 — — US claimed
JP-55062052-A — — None — — JP disclosed
JP-55057542-A — — None — — JP disclosed
JP-55057542-A — — None — — JP disclosed
JP-55062053-A — — None — — JP disclosed
JP-55062053-A — — None — — JP disclosed
JP-2000244-A — — None — — JP disclosed
JP-2000244-A — — None — — JP disclosed
JP-S5557542-A PREPARATION OF AMINOPHENOL ETHER NIPPON TOKUSHU KAGAKU KOGYO KK 1980-04-28 — — JP disclosed
US-4196286-A Process for the manufacture of basic oxazine dyestuffs CIBA-GEIGY CORPORATION (US) 1980-04-01 — — US disclosed
EP-0005451-A2 Process for the manufacture of cationic oxazinic compounds, the oxazinic compounds and their application to the dyeing and printing of textile materials CIBA-GEIGY AG (CH) 1979-11-28 — — EP disclosed
US-4125717-A NITROSATION OF AMINOPHENOL ETHERS BAYER AKTIENGESELLSCHAFT (DE) 1978-11-14 — — US disclosed
US-4125717-A NITROSATION OF AMINOPHENOL ETHERS BAYER AKTIENGESELLSCHAFT (DE) 1978-11-14 — — US disclosed
US-4096157-A PIGMENTS HOECHST AKTIENGESELLSCHAFT (DT) 1978-06-20 — — US disclosed
US-3977826-A HYDROGEN PEROXIDE, OXIDATION DYE COMPONENTS CLAIROL INCORPORATED (US) 1976-08-31 — — 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-20080171765-A1 Aniline or phenol mustards linked to DNA-affinic molecules or water-soluble aromatic rings and their use as cancer therapeutic agents WEE1, PCNA, ATIC ALOX15 3816/4885TSHR 3550/4885ALDH1A1 1144/4885

“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.

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