SCHEMBL862783

SCHEMBL862783

Cc1ccc2c(sc3c(C)cccc32)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.42
CYP2A6 P11509 3/20 0.42
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.37
TRPA1 O75762 1/20 0.37
ATM Q13315 1/20 0.37
AHR P35869 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ESR2 Q92731 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
PLAU P00749 1/20 0.33
PARP15 Q460N3 1/20 0.32
PARP10 Q53GL7 1/20 0.32

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
SCHEMBL15497403 0.87 CYP1A2 (0.50) CYP1A2CYP2A6TSHRALDH1A1AHR
SCHEMBL29364650 0.87 CYP1A2 (0.55) CYP1A2CYP2A6TSHRALDH1A1TRPA1
SCHEMBL11976506 0.87 CYP1A2 (0.37) CYP1A2CYP2A6TSHRALDH1A1CYP3A4
SCHEMBL142551 0.87 CYP1A2 (0.55) CYP1A2CYP2A6TSHRALDH1A1TRPA1
Hydrogen Sulfide SCHEMBL28590036 0.84 CYP1A2 (0.52) CYP1A2CYP2A6TSHRALDH1A1TRPA1
SCHEMBL4172425 0.82 CYP2A6 (0.38) CYP1A2CYP2A6ALDH1A1AHRPLAU
SCHEMBL22104932 0.82 CYP1A2 (0.41) CYP1A2CYP2A6ALDH1A1TRPA1ATM
SCHEMBL21449415 0.78 MAPT (0.50) CYP1A2CYP2A6TSHRALDH1A1AHR
SCHEMBL13021657 0.78 GPR3 (0.50) CYP1A2CYP2A6TSHRALDH1A1ATM
SCHEMBL30278836 0.78 GPR3 (0.50) CYP1A2CYP2A6TSHRALDH1A1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117250292-A Separation and analysis method of heteroatom compounds in petroleum geological sample and application thereof 中国石油天然气股份有限公司 2023-12-19 CN disclosed
US-11063219-B2 Organic photoelectric conversion element, and solar cell module and sensor provided with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-07-13 US disclosed
US-10290809-B2 Macromolecular compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-05-14 US disclosed
US-20190115540-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL MODULE AND SENSOR PROVIDED WITH THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-04-18 US disclosed
US-20180053868-A1 PHOTOELECTRIC CONVERSION DEVICE HAVING REFLECTION PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-22 US disclosed
US-20180053868-A1 PHOTOELECTRIC CONVERSION DEVICE HAVING REFLECTION PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-22 US disclosed
US-20170162808-A1 PHOTOELECTRIC CONVERSION DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-08 US disclosed
US-20170162808-A1 PHOTOELECTRIC CONVERSION DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-08 US disclosed
US-20160372675-A1 MACROMOLECULAR COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-22 US disclosed
US-20160372675-A1 MACROMOLECULAR COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-22 US disclosed
US-20070103059-A1 Composition and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-10 US disclosed
US-20070103059-A1 Composition and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-10 US disclosed
US-20070051922-A1 Polymer light-emitting material and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-08 US disclosed
US-20070051922-A1 Polymer light-emitting material and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-08 US disclosed
US-20070040164-A1 Polymer complex compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-02-22 US disclosed
US-20070040164-A1 Polymer complex compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-02-22 US disclosed
EP-0821982-B1 High-Temperature Desulfurization by Microorganisms JAPAN COOPERATION CT PETROLEUM (JP) 2002-05-02 EP disclosed
US-6130081-A MICROORGANISM WITH THE ABILITY TO DECOMPOSE ORGANIC SULFUR COMPOUNDS PETROLEUM ENERGY CENTER (JP) 2000-10-10 US disclosed
US-5925560-A CONTACTING ORGANIC SULFUR COMPOUNDS WITH PAENIBACILLUS; EFFICIENT CLEAVAGE OF C-S BONDS; POLLUTION CONTROL BY REMOVING SULFUR FROM PETROLEUM AND COAL PETROLEUM ENERGY CENTER (JP) 1999-07-20 US disclosed
EP-0821982-A2 High-Temperature Desulfurization by Microorganisms Petroleum Energy Center (JP) 1998-02-04 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 (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-10290809-B2 Macromolecular compound EXOSC4, TRPC6, MRPS22 CYP1A2 4239/4885CYP2A6 3652/4885TSHR 1066/4885
US-20160372675-A1 MACROMOLECULAR COMPOUND EXOSC4, TRPC6, MRPS22 CYP1A2 4239/4885CYP2A6 3652/4885TSHR 1066/4885

“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.