Sugi Predict

Sugi Predict / Compounds / SCHEMBL803431

SCHEMBL803431

SCHEMBL803431

Cc1ccc(-c2ccc(-c3ccc(C)c(F)c3F)c(F)c2F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 8/20 0.40
▸ PTGS1 P23219 3/20 0.39
▸ ACHE P22303 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ADORA3 P0DMS8 2/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ AR P10275 1/20 0.34
▸ RPS6KA3 P51812 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ PPARG P37231 1/20 0.33

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
SCHEMBL14211939 0.98 PTGS2 (0.39) PTGS2PTGS1ACHETDP1MEN1
SCHEMBL803112 0.98 PTGS2 (0.41) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL4549715 0.96 PTGS2 (0.40) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL17548830 0.96 PTGS2 (0.40) PTGS2PTGS1ACHETDP1RPS6KA3
SCHEMBL803253 0.91 PTGS2 (0.38) PTGS2PTGS1HPGD
SCHEMBL172423 0.89 ACHE (0.48) PTGS2PTGS1ACHETDP1MEN1
SCHEMBL17192339 0.87 AKR1C3 (0.43) PTGS2PTGS1SMN1; SMN2RPS6KA3PDE3B
SCHEMBL18503372 0.87 CYP1A2 (0.39) PTGS2PTGS1
SCHEMBL13417792 0.87 AKR1C3 (0.43) PTGS2PTGS1SMN1; SMN2RPS6KA3PDE3B
SCHEMBL17570168 0.86 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 88 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-11827829-B2 Liquid crystal composition containing dibenzo derivative and liquid crystal display device JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2023-11-28 — — US disclosed
US-11788010-B2 Liquid crystal composition and liquid crystal display device comprising the same JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2023-10-17 — — US disclosed
US-11781069-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2023-10-10 — — US disclosed
US-11773327-B2 PSA-type liquid crystal composition and display device having same JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2023-10-03 — — US disclosed
US-11739266-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2023-08-29 — — US disclosed
US-20230257654-A1 LIQUID CRYSTAL COMPOSITION CONTAINING DIBENZO DERIVATIVES AND LIQUID CRYSTAL DISPLAY DEVICE JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2023-08-17 — — US disclosed
US-11718791-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2023-08-08 — — US disclosed
US-11702597-B2 Azo dye MERCK PATENT GMBH (DE) 2023-07-18 — — US disclosed
US-20110101269-A1 LIQUID-CRYSTAL DISPLAY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-05-05 — — US disclosed
US-20110051049-A1 LIQUID-CRYSTAL DISPLAY MERCK PATENT GESELLSCHAFT (DE) 2011-03-03 — — US disclosed
US-20100309423-A1 Liquid Crystal Display MERCK PATENT GESELLSCHAFT (DE) 2010-12-09 — — US disclosed
US-20100272925-A1 LIQUID-CRYSTAL DISPLAY MERCK PATENT GESELLSCHAFT (DE) 2010-10-28 — — US disclosed
US-7807068-B2 reacting 4-halo-2,6-difluorophenol with protecting group, dehalogenating to form protected phenol ether group, reacting with boronic acid/ester, coupling in presence of catalyst, deblocking, etherifying, esterifying; for optical, electro-optical and electronic use, liquid-crystal media and displays MERCK PATENT GESELLSCHAFT (DE) 2010-10-05 — — US disclosed
US-7803434-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2010-09-28 — — US disclosed
US-7553523-B2 Liquid crystal medium MERCK PATENT GMBH (DE) 2009-06-30 — — US disclosed
US-20090141215-A1 POLYMERIZABLE COMPOUNDS MERCK PATENT GESELLSCHAFT (DE) 2009-06-04 — — US disclosed
US-20080191166-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GESELLSCHAFT (DE) 2008-08-14 — — US disclosed
US-20070170395-A1 Liquid crystal medium MERCK PATENT GESELLSCHAFT 2007-07-26 — — 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 (5 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-11718791-B2 Polymerisable compounds and the use thereof in liquid-crystal displays VCL, ILK, LCP1 PTGS2 4474/4885PTGS1 4504/4885ACHE 2422/4885
US-20100272925-A1 LIQUID-CRYSTAL DISPLAY KLK3, BPHL, LPXN PTGS2 4197/4885PTGS1 3504/4885ACHE 3731/4885
US-20090141215-A1 POLYMERIZABLE COMPOUNDS VCL, LCP1, LPXN PTGS2 3982/4885PTGS1 3855/4885ACHE 3512/4885
US-20110051049-A1 LIQUID-CRYSTAL DISPLAY VCL, LPXN, ACP3 PTGS2 4406/4885PTGS1 4307/4885ACHE 3746/4885
US-20110101269-A1 LIQUID-CRYSTAL DISPLAY KLK3, LPXN, PSAP PTGS2 4601/4885PTGS1 4467/4885ACHE 4072/4885

“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.