SCHEMBL3635012

SCHEMBL3635012

Cc1ccc2ccccc2c1Oc1c(C)ccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 6/20 0.58
CYP1A2 P05177 6/20 0.58
TSHR P16473 5/20 0.58
ALDH1A1 P00352 6/20 0.50
HSD17B10 Q99714 5/20 0.48
TDP1 Q9NUW8 2/20 0.48
HPRT1 P00492 1/20 0.44
HPGD P15428 3/20 0.44
HIF1A Q16665 2/20 0.42
CYP3A4 P08684 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
RAB9A P51151 1/20 0.42
CASP7 P55210 1/20 0.42
ATM Q13315 1/20 0.42
CYP1B1 Q16678 1/20 0.41
LCK P06239 1/20 0.40
FYN P06241 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
SCHEMBL1824124 0.84 TSHR (0.56) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL24299848 0.83 CYP2A6 (0.54) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL3420545 0.81 CYP2A6 (0.52) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL5249927 0.79 CYP2A6 (0.50) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL13588225 0.79 TSHR (0.50) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL19080432 0.78 TSHR (0.48) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL22207935 0.78 CYP2A6 (0.48) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL11811296 0.78 TSHR (0.48) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL2497894 0.78 TSHR (0.48) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL15863499 0.78 CYP1A2 (0.48) CYP2A6CYP1A2TSHRALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963474-B1 ODOUR REDUCTION FOR AGENTS CONTAINING HYPOCHLORITE HENKEL AG & CO KGAA (DE) 2016-11-02 EP claimed
EP-1894976-B1 POLYMER COMPOSITION AND POLYMER LIGHT-EMITTING DEVICE USING SAME SUMITOMO CHEMICAL CO (JP) 2015-09-30 EP claimed
EP-2171029-B1 GENTLE BLEACH HENKEL AG & CO KGAA (DE) 2012-11-07 EP claimed
EP-2171029-A1 GENTLE BLEACH Henkel AG & Co. KGaA (DE) 2010-04-07 EP claimed
WO-2009013116-A1 GENTLE BLEACH HENKEL AG & CO. KGAA (DE) 2009-01-29 WO claimed
EP-1963474-A1 ODOUR REDUCTION FOR AGENTS CONTAINING HYPOCHLORITE Henkel AG & Co. KGaA (DE) 2008-09-03 EP claimed
WO-2007079870-A1 ODOUR REDUCTION FOR AGENTS CONTAINING HYPOCHLORITE HENKEL AG & CO. KGAA (DE) 2007-07-19 WO claimed
EP-0545556-B1 Perfume composition QUEST INT (NL) 1997-07-23 EP claimed
US-20230242705-A1 ESTER COMPOUND AND RESIN COMPOSITION AJINOMOTO CO., INC. (JP) 2023-08-03 US disclosed
US-20230157163-A1 ORGANIC COMPOUND, PREPARATION METHOD THEREOF, AND DISPLAY PANEL WUHAN CHINA STAR OPTOELECTRONICS SEMICONDUCTOR DISPLAY TECHNOLOGY CO., LTD. (CN) 2023-05-18 US disclosed
CN-111226504-A Method for manufacturing organic electronic device 住友化学株式会社 2020-06-02 CN disclosed
CN-107210380-B Composition and the light-emitting component for using the composition 住友化学株式会社 2019-06-28 CN disclosed
CN-107210380-A Composition and the light-emitting component using said composition 住友化学株式会社 2017-09-26 CN disclosed
CN-106470825-A For manufacturing the dry fibers band of preform 塞特工业公司 2017-03-01 CN disclosed
EP-0492940-A1 Process for producing and purifying 3,4-dihydrocoumarin SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1992-07-01 EP disclosed
US-4546139-A FIRE RETARDANT ADDITIVE TO POLYMERS PPG INDUSTRIES, INC. (US) 1985-10-08 US disclosed
EP-0092738-B1 PROCESS FOR THE CONTINUOUS THERMAL DECOMPOSITION OF CARBAMIC-ACID ESTERS BAYER AG (DE) 1985-07-24 EP disclosed
US-4487713-A HEAT TREATMENT WITH TITANIUM, TIN, ANTIMONY OR ZIRCONIUM COMPOUND EXXON RESEARCH & ENGINEERING CO. (US) 1984-12-11 US disclosed
EP-0092738-A1 Process for the continuous thermal decomposition of carbamic-acid esters BAYER AG (DE) 1983-11-02 EP disclosed
US-3933543-A OXIDIZER, A NON-METAL, A FUEL ATLANTIC RESEARCH CORPORATION (US) 1976-01-20 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-20230157163-A1 ORGANIC COMPOUND, PREPARATION METHOD THEREOF, AND DISPLAY PANEL HTR4, AR, HTR2C CYP2A6 515/4885CYP1A2 81/4885TSHR 2340/4885
US-20230242705-A1 ESTER COMPOUND AND RESIN COMPOSITION AFF4, AFF1, AFF2 CYP2A6 1136/4885CYP1A2 1146/4885TSHR 4043/4885

“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.