SCHEMBL8192072

SCHEMBL8192072

Cc1ccc(-c2cc(F)c(F)c(F)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.43
PTGS2 P35354 2/20 0.41
ANPEP P15144 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
PTGS1 P23219 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RPS6KA3 P51812 1/20 0.40
NFE2L2 Q16236 1/20 0.39
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 2/20 0.39
RAPGEF4 Q8WZA2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAOB P27338 1/20 0.37
AR P10275 1/20 0.36

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
SCHEMBL16258106 1.00 ACHE (0.43) ACHEPTGS2ANPEPTDP1PTGS1
SCHEMBL10014228 1.00 ACHE (0.43) ACHEPTGS2ANPEPTDP1PTGS1
SCHEMBL16258066 0.93 KDM4E (0.40) ACHEPTGS2ANPEPTDP1PTGS1
SCHEMBL16258104 0.93 KDM4E (0.40) ACHEPTGS2ANPEPTDP1PTGS1
SCHEMBL16521126 0.88 RAPGEF4 (0.35) ACHEPTGS2ANPEPPTGS1MEN1
SCHEMBL17070827 0.88 RAPGEF4 (0.35) ACHEPTGS2ANPEPPTGS1MEN1
SCHEMBL17108385 0.87 ANPEP (0.42) PTGS2ANPEPKDM4E
SCHEMBL21919585 0.86 PTGS2 (0.41) ACHEPTGS2TDP1PTGS1MEN1
SCHEMBL10018705 0.85 ACHE (0.43) ACHEPTGS2TDP1PTGS1MEN1
SCHEMBL13614626 0.85 ACHE (0.43) ACHEPTGS2TDP1PTGS1MEN1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230309388-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-09-28 US disclosed
WO-2016198143-A1 CHIRAL DOPANTS HAVING A NORTRICYCLAN UNIT MERCK PATENT GMBH (DE) 2016-12-15 WO disclosed
US-20160024383-A1 LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2016-01-28 US disclosed
EP-2806011-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC Corporation (JP) 2014-11-26 EP disclosed
US-8519145-B2 Aryl compounds as PPAR ligands and their use SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2013-08-27 US disclosed
US-8519145-B2 Aryl compounds as PPAR ligands and their use SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2013-08-27 US disclosed
US-20120271055-A1 ARYL COMPOUNDS AS PPAR LIGANDS AND THEIR USE SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2012-10-25 US disclosed
US-20120271055-A1 ARYL COMPOUNDS AS PPAR LIGANDS AND THEIR USE SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2012-10-25 US disclosed
US-7888519-B2 Liquid crystals; using metastasis catalysts; reduction, hydrogenation MERCK PATENT GESELLSCHAFT (DE) 2011-02-15 US disclosed
US-7888519-B2 Liquid crystals; using metastasis catalysts; reduction, hydrogenation MERCK PATENT GESELLSCHAFT (DE) 2011-02-15 US disclosed
EP-1768117-B1 LIQUID CRYSTAL LIGHT MODULATING ELEMENT AND OPTICAL HEAD DEVICE ASAHI GLASS CO LTD (JP) 2010-10-20 EP disclosed
US-7462297-B2 Chiral dopants having a laterally alkylated phenyl structural element MERCK PATENT GMBH (DE) 2008-12-09 US disclosed
US-7462297-B2 Chiral dopants having a laterally alkylated phenyl structural element MERCK PATENT GMBH (DE) 2008-12-09 US disclosed
WO-2008066356-A1 ARYL COMPOUNDS AS PPAR LIGANDS AND THEIR USE SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2008-06-05 WO disclosed
US-7314943-B2 Pyran derivatives containing an exocyclic double bond MERCK PATENT GMBH (DE) 2008-01-01 US disclosed
US-7314943-B2 Pyran derivatives containing an exocyclic double bond MERCK PATENT GMBH (DE) 2008-01-01 US disclosed
US-5032313-A Trifluorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1991-07-16 US disclosed
EP-0387032-A1 Trifluorobenzene derivatives and liquid crystal compositions containing the same Chisso Corporation (JP) 1990-09-12 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-20120271055-A1 ARYL COMPOUNDS AS PPAR LIGANDS AND THEIR USE PPARG, PPARA, PPARD ACHE 63/4885PTGS2 2180/4885ANPEP 4072/4885
US-20230309388-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE OCIAD1, OCIAD2, SLCO4C1 ACHE 1667/4885PTGS2 4005/4885ANPEP 4558/4885

“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.