Sugi Predict

Sugi Predict / Compounds / SCHEMBL803238

SCHEMBL803238

SCHEMBL803238

Cc1ccc(-c2ccc(-c3ccc(C)c(F)c3)cc2F)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 3/20 0.50
▸ AKR1C2 P52895 3/20 0.50
▸ AKR1B10 O60218 2/20 0.48
▸ AKR1C4 P17516 2/20 0.48
▸ AKR1C1 Q04828 2/20 0.48
▸ PDE3B Q13370 3/20 0.46
▸ PDE3A Q14432 3/20 0.46
▸ PTGS2 P35354 5/20 0.43
▸ PTGS1 P23219 2/20 0.42
▸ RPS6KA3 P51812 1/20 0.41
▸ NISCH Q9Y2I1 1/20 0.41
▸ ERN1 O75460 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KMO O15229 2/20 0.37

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
SCHEMBL10024806 0.94 AKR1C3 (0.53) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL803430 0.94 AKR1C3 (0.53) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL4567630 0.92 PDE3B (0.50) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL17914331 0.91 AKR1C3 (0.50) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL21374093 0.90 PTGS2 (0.46) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL23173084 0.90 AKR1C3 (0.58) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL170435 0.90 PDE3B (0.49) AKR1C3AKR1C2PDE3BPDE3APTGS2
SCHEMBL13703908 0.90 AKR1C3 (0.58) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL14365640 0.88 AKR1C3 (0.54) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1
SCHEMBL10018722 0.88 AKR1C3 (0.54) AKR1C3AKR1C2AKR1B10AKR1C4AKR1C1

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 85 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-11781069-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2023-10-10 — — 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-11685863-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2023-06-27 — — US disclosed
US-11667845-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2023-06-06 — — US disclosed
US-11655417-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2023-05-23 — — US disclosed
US-20180201837-A1 Method of Reducing ODF Mura in Polymer Stabilised Liquid Crystal Displays MERCK PATENT GMBH (DE) 2018-07-19 — — US disclosed
US-20180195003-A1 PROCESS FOR THE STABILISATION OF LIQUID CRYSTAL MEDIA MERCK PATENT GMBH (DE) 2018-07-12 — — US disclosed
US-20180179446-A1 LIQUID CRYSTAL MEDIUM CONTAINING POLYMERISABLE COMPOUNDS MERCK PATENT GMBH (DE) 2018-06-28 — — US disclosed
US-20100309423-A1 Liquid Crystal Display MERCK PATENT GESELLSCHAFT (DE) 2010-12-09 — — US disclosed
US-20100304049-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-12-02 — — 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-20100188618-A1 LIQUID-CRYSTAL DISPLAY MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2010-07-29 — — US disclosed
US-7731865-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2010-06-08 — — US disclosed
US-20090324853-A1 LIQUID-CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2009-12-31 — — US 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-20080090026-A1 Liquid-crystal display MERCK PATENT GMBH 2008-04-17 — — 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 (7 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 AKR1C3 4067/4885AKR1C2 4097/4885AKR1B10 4234/4885
US-11667845-B2 Liquid crystalline medium NEFM, CCNI, MYT1 AKR1C3 4108/4885AKR1C2 4449/4885AKR1B10 4312/4885
US-20100272925-A1 LIQUID-CRYSTAL DISPLAY KLK3, BPHL, LPXN AKR1C3 2930/4885AKR1C2 2659/4885AKR1B10 2628/4885
US-11685863-B2 Polymerisable compounds and the use thereof in liquid-crystal displays LPXN, VCL, LCP1 AKR1C3 3514/4885AKR1C2 3386/4885AKR1B10 3441/4885
US-20080090026-A1 Liquid-crystal display KLK3, LPXN, BPHL AKR1C3 3095/4885AKR1C2 2576/4885AKR1B10 2010/4885
US-20090141215-A1 POLYMERIZABLE COMPOUNDS VCL, LCP1, LPXN AKR1C3 3773/4885AKR1C2 3623/4885AKR1B10 3269/4885
US-20100188618-A1 LIQUID-CRYSTAL DISPLAY KLK3, LPXN, PSAP AKR1C3 3702/4885AKR1C2 3470/4885AKR1B10 3026/4885

“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.