SCHEMBL12377032

SCHEMBL12377032

Cc1ccc(-c2ccc(-c3ccc(C#N)cc3)cc2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.84
ALDH1A1 P00352 1/20 0.84
MMP3 P08254 1/20 0.58
KIF11 P52732 2/20 0.58
CA12 O43570 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
CA1 P00915 1/20 0.48
CYP11B2 P19099 4/20 0.47
CYP11B1 P15538 1/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 1/20 0.47
MAPKAPK2 P49137 1/20 0.46
CA3 P07451 1/20 0.46
CA6 P23280 1/20 0.46
CA14 Q9ULX7 1/20 0.46
AR P10275 2/20 0.46
BCHE P06276 1/20 0.44
ACHE P22303 1/20 0.44

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
Water SCHEMBL28512959 1.00 CYP2A6 (0.84) CYP2A6ALDH1A1MMP3KIF11CA12
SCHEMBL91813 1.00 CYP2A6 (0.84) CYP2A6ALDH1A1MMP3KIF11CA12
SCHEMBL27329500 0.92 CYP2A6 (1.00) CYP2A6ALDH1A1MMP3KIF11CA12
P-Xylene SCHEMBL3926102 0.92 CYP2A6 (1.00) CYP2A6ALDH1A1MMP3KIF11CA12
SCHEMBL46818 0.92
SCHEMBL28089251 0.89 CYP2A6 (0.94) CYP2A6ALDH1A1MMP3KIF11CA12
SCHEMBL31070291 0.87 ALDH1A1 (0.64) CYP2A6ALDH1A1MMP3KIF11AR
Cyanide SCHEMBL6561699 0.86 CYP2A6 (0.89) CYP2A6ALDH1A1MMP3KIF11CA12
Water SCHEMBL11055485 0.86 MMP3 (0.74) CYP2A6ALDH1A1MMP3KIF11CA12
SCHEMBL396846 0.86 MMP3 (0.74) CYP2A6ALDH1A1MMP3KIF11CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250011590-A1 OPTICAL FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2025-01-09 US disclosed
EP-4431989-A1 OPTICAL FILM AND POLARIZING PLATE Tosoh Corporation (JP) 2024-09-18 EP disclosed
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed
US-20240228878-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION, AS WELL AS LIQUID CRYSTAL DISPLAY ELEMENT, SENSOR, LIQUID CRYSTAL LENS, OPTICAL COMMUNICATION EQUIPMENT, AND ANTENNA EACH USING THE SAME DIC CORPORATION (JP) 2024-07-11 US disclosed
US-20240228878-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION, AS WELL AS LIQUID CRYSTAL DISPLAY ELEMENT, SENSOR, LIQUID CRYSTAL LENS, OPTICAL COMMUNICATION EQUIPMENT, AND ANTENNA EACH USING THE SAME DIC CORPORATION (JP) 2024-07-11 US disclosed
EP-4299283-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE Tosoh Corporation (JP) 2024-01-03 EP disclosed
US-20230399567-A1 Liquid Crystal Element and Emulsion Composition MITSUBISHI CHEMICAL CORPORATION (JP) 2023-12-14 US disclosed
WO-2023090353-A1 OPTICAL FILM AND POLARIZING PLATE 東ソー株式会社 2023-05-25 WO disclosed
WO-2022210589-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE 東ソー株式会社 2022-10-06 WO disclosed
EP-3944011-A1 LIQUID-CRYSTAL DISPLAY Merck Patent GmbH (DE) 2022-01-26 EP disclosed
US-7678929-B2 Furochroman derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-03-16 US disclosed
US-20090247620-A1 Benzochromene Derivatives for Use in Liquid Crystal Media and as Therapeutic Active Substances MERCK PATENT GMBH (DE) 2009-10-01 US disclosed
US-20090023802-A1 Benzochromene Derivatives MERCK PATENT GMBH (DE) 2009-01-22 US disclosed
EP-2006352-A1 LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL ELEMENT Chisso Corporation (JP) 2008-12-24 EP disclosed
US-7440160-B2 Electro-optical light modulating element, electro-optical display and modulating medium MERCK PATENT GMBH (DE) 2008-10-21 US disclosed
US-20080177095-A1 FUROCHROMAN DERIVATIVES MERCK PATENT GMBH (DE) 2008-07-24 US disclosed
US-7361288-B2 Components for high-frequency technology MERCK PATENT GESELLSCHAFT MIT BESSCHRANKTER HAFTUNG (DE) 2008-04-22 US disclosed
EP-1116770-B1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY USING THE SAME DAINIPPON INK & CHEMICALS (JP) 2008-04-02 EP disclosed
US-7326447-B2 Benzochromene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-02-05 US disclosed
US-7314653-B2 Liquid-crystal medium and electro-optical display containing same MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-01-01 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-20080177095-A1 FUROCHROMAN DERIVATIVES CFD, LMAN1, UROD CYP2A6 2847/4885ALDH1A1 1075/4885MMP3 1812/4885
US-20090247620-A1 Benzochromene Derivatives for Use in Liquid Crystal Media and as Therapeutic Active Substances LPO, SBDS, OCIAD1 CYP2A6 1448/4885ALDH1A1 1625/4885MMP3 3368/4885
US-20090023802-A1 Benzochromene Derivatives SBDS, CRY1, DDT CYP2A6 269/4885ALDH1A1 676/4885MMP3 3146/4885
US-20240228878-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION, AS WELL AS LIQUID CRYSTAL DISPLAY ELEMENT, SENSOR, LIQUID CRYSTAL LENS, OPTICAL COMMUNICATION EQUIPMENT, AND ANTENNA EACH USING THE SAME TTI2, CCT4, CCT2 CYP2A6 4709/4885ALDH1A1 4223/4885MMP3 4557/4885

“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.