SCHEMBL939375

SCHEMBL939375

Cc1cccc2c1sc1cccc(C)c12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.48
CYP1A2 P05177 2/20 0.48
ALDH1A1 P00352 6/20 0.43
MAPT P10636 6/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
POLB P06746 2/20 0.43
HCRTR1 O43613 1/20 0.43
LMNA P02545 1/20 0.43
GPR3 P46089 1/20 0.40
PLAU P00749 1/20 0.39
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
TP53 P04637 1/20 0.36
APP P05067 1/20 0.35
CHRM2 P08172 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
MAOA P21397 1/20 0.35

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
SCHEMBL29735389 1.00 CYP2A6 (0.48) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL6130179 0.96 CYP2A6 (0.44) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL16491838 0.88 CYP2A6 (0.38) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL29388065 0.86 GPR3 (0.54) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL731864 0.86 GPR3 (0.54) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
Dibenzothiophene SCHEMBL6130180 0.85 GPR3 (0.58) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL21449415 0.84 MAPT (0.50) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL2542231 0.84 GPR3 (0.56) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL16283910 0.84 LIMK1 (0.48) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1
SCHEMBL18347527 0.84 TSHR (0.46) CYP2A6CYP1A2ALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024126322-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-06-20 WO disclosed
US-20240067886-A1 DESULFURIZATION PROCESS SOLVAY SA (BE) 2024-02-29 US disclosed
EP-3238286-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-01-17 EP disclosed
US-11832513-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2023-11-28 US disclosed
US-11832513-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2023-11-28 US disclosed
US-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-10-12 US disclosed
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-10-12 US disclosed
EP-4255151-A2 SPIRO[FLUORENE-9,9'-(THIO)XANTHENE] COMPOUNDS Merck Patent GmbH (DE) 2023-10-04 EP disclosed
US-20160190466-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-06-30 US disclosed
US-20160056392-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND LIGHTING DEVICE AND DISPLAY DEVICE WHICH ARE PROVIDED WITH SAME Konica Minolta, Inc. (JP) 2016-02-25 US disclosed
US-20160056392-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND LIGHTING DEVICE AND DISPLAY DEVICE WHICH ARE PROVIDED WITH SAME Konica Minolta, Inc. (JP) 2016-02-25 US disclosed
EP-2980878-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND LIGHTING DEVICE AND DISPLAY DEVICE WHICH ARE PROVIDED WITH SAME Konica Minolta, Inc. (JP) 2016-02-03 EP disclosed
US-20150322337-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, AND DISPLAY DEVICE Konica Minolta, Inc. (JP) 2015-11-12 US disclosed
US-20150322337-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, AND DISPLAY DEVICE Konica Minolta, Inc. (JP) 2015-11-12 US disclosed
EP-2930762-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, AND DISPLAY DEVICE Konica Minolta, Inc. (JP) 2015-10-14 EP disclosed
US-7871501-B2 Laser-based method for removal of sulfur (DMDBT) in hydrocarbon fuels KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2011-01-18 US disclosed
CN-101522570-A Catalytic process for deep oxidative desulfurization of liquid vehicle fuels SAUDI ARABIAN OIL CO UNIV OXFO (SA) 2009-09-02 CN disclosed
US-20080110802-A1 Laser-based method for removal of sulfur (DMDBT) in hydrocarbon fuels KING FAHD UNIV. OF PETROLEUM AND MINERALS (SA) 2008-05-15 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 (4 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-11832513-B2 Materials for electronic devices PNMT, DDT, COMT CYP2A6 120/4885CYP1A2 26/4885ALDH1A1 321/4885
US-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP2E1, GPX1, ERCC1 CYP2A6 188/4885CYP1A2 46/4885ALDH1A1 115/4885
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES SOD1, GPX1, EFNA1 CYP2A6 792/4885CYP1A2 191/4885ALDH1A1 595/4885
US-20160190466-A1 MATERIALS FOR ELECTRONIC DEVICES SDHB, SDHA, ETFB CYP2A6 1586/4885CYP1A2 744/4885ALDH1A1 150/4885

“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.