SCHEMBL803112

SCHEMBL803112

Cc1ccc(-c2ccc(C)c(F)c2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.41
PTGS1 P23219 3/20 0.40
ACHE P22303 2/20 0.40
TDP1 Q9NUW8 1/20 0.36
RPS6KA3 P51812 1/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
GCGR P47871 1/20 0.33
MAPK14 Q16539 1/20 0.33
COMT P21964 1/20 0.33
NFE2L2 Q16236 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
SCHEMBL17548830 0.98 PTGS2 (0.40) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL4549715 0.98 PTGS2 (0.40) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL803431 0.98 PTGS2 (0.40) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL14211939 0.96 PTGS2 (0.39) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL803253 0.93 PTGS2 (0.38) PTGS2PTGS1
SCHEMBL172423 0.91 ACHE (0.48) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL18503372 0.89 CYP1A2 (0.39) PTGS2PTGS1
SCHEMBL13417792 0.89 AKR1C3 (0.43) PTGS2PTGS1RPS6KA3PDE3BPDE3A
SCHEMBL17192339 0.89 AKR1C3 (0.43) PTGS2PTGS1RPS6KA3PDE3BPDE3A
SCHEMBL17570168 0.88 ACHE (0.46) PTGS2PTGS1ACHETDP1RPS6KA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239818-A Preparation method of fluorobiphenyl compound 沈阳中化农药化工研发有限公司 2024-06-25 CN claimed
US-12043781-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2024-07-23 US disclosed
US-20240228879-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2024-07-11 US disclosed
WO-2024133363-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2024-06-27 WO disclosed
CN-118239818-A Preparation method of fluorobiphenyl compound 沈阳中化农药化工研发有限公司 2024-06-25 CN disclosed
US-20240067879-A1 Liquid-crystal medium MERCK PATENT GMBH (DE) 2024-02-29 US disclosed
CN-117603174-A Method for preparing benzoepoxidation heterocycle by visible light photocatalysis 河南大学 2024-02-27 CN disclosed
WO-2024017812-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2024-01-25 WO disclosed
US-20240026223-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE COMPRISING SAME JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2024-01-25 US disclosed
EP-4306615-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2024-01-17 EP disclosed
US-20090141215-A1 POLYMERIZABLE COMPOUNDS MERCK PATENT GESELLSCHAFT (DE) 2009-06-04 US disclosed
US-20090103011-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GESELLSCHAFT (DE) 2009-04-23 US disclosed
US-20080308768-A1 Liquid Crystalline Medium MERCK PATENT GMBH (DE) 2008-12-18 US disclosed
US-7462297-B2 Chiral dopants having a laterally alkylated phenyl structural element MERCK PATENT GMBH (DE) 2008-12-09 US disclosed
US-20080191166-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GESELLSCHAFT (DE) 2008-08-14 US disclosed
US-7371437-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2008-05-13 US disclosed
US-20080090026-A1 Liquid-crystal display MERCK PATENT GMBH 2008-04-17 US disclosed
US-7195719-B1 High polarization ferroelectric liquid crystal compositions DISPLAYTECH, INC. (US) 2007-03-27 US disclosed
US-7195719-B1 High polarization ferroelectric liquid crystal compositions DISPLAYTECH, INC. (US) 2007-03-27 US disclosed
US-20070051920-A1 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2007-03-08 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-20080090026-A1 Liquid-crystal display KLK3, LPXN, BPHL PTGS2 4553/4885PTGS1 4286/4885ACHE 4670/4885
US-20090141215-A1 POLYMERIZABLE COMPOUNDS VCL, LCP1, LPXN PTGS2 3982/4885PTGS1 3855/4885ACHE 3512/4885

“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.