SCHEMBL487040

SCHEMBL487040

CC(C)Nc1cccc(O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
CYP1A2 P05177 2/20 0.57
TDP1 Q9NUW8 2/20 0.54
CYP3A4 P08684 4/20 0.53
KMT2A Q03164 4/20 0.53
HSD17B10 Q99714 3/20 0.53
ALOX15 P16050 2/20 0.53
ALOX12 P18054 2/20 0.53
MEN1 O00255 2/20 0.53
USP2 O75604 1/20 0.53
APP P05067 1/20 0.53
HSP90AA1 P07900 1/20 0.53
HSP90AB1 P08238 1/20 0.53
CYP2D6 P10635 1/20 0.53
MAPT P10636 1/20 0.53
CYP2C9 P11712 1/20 0.53
MAPK1 P28482 1/20 0.53
CYP2C19 P33261 1/20 0.53
SNCA P37840 1/20 0.53
TSHR P16473 2/20 0.52

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
SCHEMBL2371986 0.85 ALDH1A1 (0.51) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10
SCHEMBL9313156 0.84 TDP1 (0.67) ALDH1A1CYP1A2TDP1CYP3A4KMT2A
SCHEMBL10915411 0.83 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10
SCHEMBL8085472 0.80 ALDH1A1 (0.55) ALDH1A1CYP1A2TDP1CYP3A4KMT2A
SCHEMBL10914621 0.79 ALDH1A1 (0.54) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10
SCHEMBL10914381 0.79 KMT2A (0.46) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10
SCHEMBL5328095 0.79 CYP3A4 (0.53) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10
SCHEMBL11434065 0.79 CYP3A4 (0.53) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10
SCHEMBL5328091 0.79 CYP3A4 (0.53) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10
SCHEMBL11309120 0.79 ALDH1A1 (0.46) ALDH1A1CYP1A2CYP3A4KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-10-12 US disclosed
US-20230219894-A1 DISUBSTITUTED ADAMANTYL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION FOR SUPPRESSING CANCER GROWTH COMPRISING SAME AS ACTIVE INGREDIENT ONECUREGEN CO., LTD. (KR) 2023-07-13 US disclosed
CN-104203944-B Multi-fluorescent substance containing coumarin derivative and diagnostic LED light source micro-fluorescence quantitative biosensor using same 点标生物股份有限公司 2017-03-01 CN disclosed
CN-102749806-B Colored curable resin composition 住友化学株式会社 2016-10-26 CN disclosed
US-9354234-B2 Multi-fluorescent substance including novel coumarin derivative, and LED light source-based microfluorescent quantitative biosensor for diagnosis using same GENBODY INC. (KR) 2016-05-31 US disclosed
US-9354234-B2 Multi-fluorescent substance including novel coumarin derivative, and LED light source-based microfluorescent quantitative biosensor for diagnosis using same GENBODY INC. (KR) 2016-05-31 US disclosed
US-9354234-B2 Multi-fluorescent substance including novel coumarin derivative, and LED light source-based microfluorescent quantitative biosensor for diagnosis using same GENBODY INC. (KR) 2016-05-31 US disclosed
CN-102838578-B Salt and cured composition for color SUMITOMO CHEMICAL CO.,LTD. (JP) 2016-03-16 CN disclosed
CN-102618085-B Salt and dyestuff SUMITOMO CHEMICAL CO., LTD. (JP) 2015-11-25 CN disclosed
CN-104203944-A Multi-fluorescent substance containing novel coumarin derivative and LED light source micro-fluorescence quantitative biosensor for diagnosis using same ACCOBIOTECH SDN BHD 2014-12-10 CN disclosed
EP-1798216-A1 INTERMEDIATE OF 6-SUBSTITUTED-1-METHYL-1-H-BENZIMIDAZOLE DERIVATIVE AND METHOD FOR PRODUCING SAME Sankyo Company, Limited (JP) 2007-06-20 EP disclosed
CN-1084327-C Method for preparing amino-phenol CIBA SC HOLDING AG (CH) 2002-05-08 CN disclosed
EP-0831081-B1 Production of aminophenols CIBA SC HOLDING AG (CH) 2000-11-02 EP disclosed
US-5908961-A UNDER AQUEOUS ACIDIC CONDITIONS; CONTINUOUS MONITORING OFPH CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-06-01 US disclosed
CN-1178785-A Method for preparing amino-phenol CIBA GEIGY AG (CH) 1998-04-15 CN disclosed
EP-0831081-A1 Production of aminophenols Ciba SC Holding AG (CH) 1998-03-25 EP disclosed
EP-0176161-A1 Novel fluoran compounds and production and use thereof TAOKA CHEMICAL CO., LTD (JP) 1986-04-02 EP disclosed
US-4231963-A ETHERIFICATION OF ALKALI METAL AMINOPHENOLATE IHARA CHEMICAL INDUSTRY COMPANY, LIMITED (JP) 1980-11-04 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-4124640-A FORM HYDROXYANILINE AND ALKYL HALIDE, NONPROTONIC ORGANIC SOLVENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1978-11-07 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 (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-20230219894-A1 DISUBSTITUTED ADAMANTYL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION FOR SUPPRESSING CANCER GROWTH COMPRISING SAME AS ACTIVE INGREDIENT AK2, CS, GOT2 ALDH1A1 509/4885CYP1A2 3405/4885TDP1 1373/4885
US-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS YTHDF1, YTHDF3, YTHDF2 ALDH1A1 4553/4885CYP1A2 4669/4885TDP1 1230/4885

“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.