SCHEMBL502980

SCHEMBL502980

CCCc1ccc(-c2ccc(-c3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
RARB P10826 4/20 0.35
RARA P10276 2/20 0.34
RARG P13631 1/20 0.34
GRM2 Q14416 1/20 0.34
MCL1 Q07820 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
KIF11 P52732 1/20 0.32
PDK2 Q15119 1/20 0.30
MAOB P27338 1/20 0.30
PTGS2 P35354 1/20 0.30
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL30106832 1.00 S1PR1 (0.35) S1PR1S1PR3RARBRARARARG
SCHEMBL12625465 1.00 S1PR1 (0.35) S1PR1S1PR3RARBRARARARG
SCHEMBL12625441 0.99 S1PR1 (0.35) S1PR1S1PR3RARBRARARARG
SCHEMBL1813180 0.97 GRM2 (0.37) S1PR1S1PR3RARBRARARARG
SCHEMBL12625449 0.96 S1PR1 (0.33) S1PR1S1PR3RARBRARARARG
SCHEMBL21564996 0.95 RARB (0.37) S1PR1S1PR3RARBRARARARG
SCHEMBL12623683 0.94 S1PR1 (0.35) S1PR1S1PR3RARBRARARARG
SCHEMBL18061215 0.94 GRM2 (0.37) S1PR1S1PR3RARBRARARARG
SCHEMBL16683680 0.93 S1PR1 (0.33) S1PR1S1PR3RARBRARARARG
SCHEMBL3439570 0.93 RARB (0.41) S1PR1S1PR3RARBRARARARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4317124-A1 METHOD FOR PRODUCING ORGANIC FLUORINE COMPOUNDS DAIKIN INDUSTRIES, LTD. (JP) 2024-02-07 EP disclosed
US-11053441-B2 Liquid crystal composition and liquid crystal display device JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2021-07-06 US disclosed
US-10788715-B2 Photo-alignment material and photo-alignment method TOKYO INSTITUTE OF TECHNOLOGY (JP) 2020-09-29 US disclosed
US-10723947-B2 Liquid crystal composition and liquid crystal display device thereof JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-07-28 US disclosed
US-20200123443-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-04-23 US disclosed
WO-2020026583-A1 LIQUID CRYSTAL COMPOUND COMPRISING BENZOTHIAZOLE RING AND CF2O LIGAND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC株式会社 2020-02-06 WO disclosed
US-20190345387-A1 LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY DEVICE EMPLOYING THE SAME DAXIN MATERIALS CORPARATION (TW) 2019-11-14 US disclosed
US-20190086738-A1 PHOTO-ALIGNMENT MATERIAL AND PHOTO-ALIGNMENT METHOD TOKYO INSTITUTE OF TECHNOLOGY (JP) 2019-03-21 US disclosed
US-10017694-B2 Liquid crystal medium containing 2,4-diflurophenyl compounds and use SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2018-07-10 US disclosed
US-20180171229-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20120229751-A1 LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-09-13 US disclosed
US-20120099039-A1 CHLOROBENZENE DERIVATIVE, OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM, AND OPTICAL DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-04-26 US disclosed
US-20120068114-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20120029194-A1 LIQUID CRYSTAL COMPOUND HAVING DIFLUOROPROPENYLENEOXY BONDING GROUP CHISSO PETROCHEMICAL CORPORATION (JP) 2012-02-02 US disclosed
US-20120015115-A1 DISPLAY PANEL AU OPTRONICS CORPORATION (TW) 2012-01-19 US disclosed
US-7709066-B2 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2010-05-04 US disclosed
US-20090091703-A1 satisfies at least one characteristic such as high maximum temperature of nematic phase, a low minimum temperature of a nematic phase, a small viscosity, a large optical anisotropy, a large dielectric anisotropy, a large specific resistance, high stability to ultraviolet light and high stability to heat CHISSO CORPORATION (JP) 2009-04-09 US disclosed
US-7470456-B2 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2008-12-30 US disclosed
US-20070278450-A1 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION 2007-12-06 US disclosed
US-20070278450-A1 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION 2007-12-06 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-20120099039-A1 CHLOROBENZENE DERIVATIVE, OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM, AND OPTICAL DEVICE CRYAB, CYBA, CCNB1 S1PR1 4265/4885S1PR3 3929/4885RARB 153/4885
US-20120029194-A1 LIQUID CRYSTAL COMPOUND HAVING DIFLUOROPROPENYLENEOXY BONDING GROUP LEF1, EIF4A3, TCF4 S1PR1 2027/4885S1PR3 1406/4885RARB 3142/4885

“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.