SCHEMBL1531772

SCHEMBL1531772

CCCCC[C@H]1CC[C@H](c2ccc(O)cc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 12/20 0.65
ESR1 P03372 6/20 0.59
CYP2C9 P11712 3/20 0.59
CYP3A4 P08684 2/20 0.59
CYP2D6 P10635 1/20 0.53
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
MEN1 O00255 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49
SPHK1 Q9NYA1 1/20 0.45

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
SCHEMBL220950 1.00 ESR2 (0.65) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL17866683 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL9379991 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL27650866 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL9815696 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL9379988 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL19722185 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL17866684 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL4337530 0.98 ESR2 (0.63) ESR2ESR1CYP2C9CYP3A4CYP2D6
SCHEMBL21321769 0.95 ESR2 (0.59) ESR2ESR1CYP2C9CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114656334-B Phenolic oligomer, preparation method thereof and asphaltene deposition inhibitor composition 中国石油化工股份有限公司 2024-04-02 CN disclosed
CN-114763469-B Oil-soluble paraffin removal and prevention agent and preparation method thereof 中国石油化工股份有限公司 2024-02-09 CN disclosed
CN-114763469-A Oil-soluble paraffin removal and prevention agent and preparation method thereof 中国石油化工股份有限公司 2022-07-19 CN disclosed
CN-114656334-A Phenolic aldehyde oligomer, preparation method thereof and asphaltene deposition inhibitor composition 中国石油化工股份有限公司 2022-06-24 CN disclosed
CN-106701106-B Alignment mechanism for optical dyes 光学转变公司 2022-03-29 CN disclosed
EP-3202798-B1 BLOCK COPOLYMER LG CHEMICAL LTD (KR) 2022-01-12 EP disclosed
CN-107033076-B Polymerizable liquid crystal compound, composition, liquid crystal polymer films thereof, method for producing same, and use thereof 捷恩智株式会社 2021-11-02 CN disclosed
US-10975307-B2 Liquid crystalline epoxy compound with terminal mesogen connected by flexible linkage and method for preparing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2021-04-13 US disclosed
US-10655066-B2 Optical isomer DIC CORPORATION (JP) 2020-05-19 US disclosed
US-10581022-B2 Polymerizable liquid crystal compound, composition, liquid crystal polymerization film-kind thereof and use thereof JNC CORPORATION (JP) 2020-03-03 US disclosed
EP-0388141-A1 Ferroelectric liquid crystal device SHARP KABUSHIKI KAISHA (JP) 1990-09-19 EP disclosed
US-4909957-A Containing lactone ring structure DAISO CO., LTD. (JP) 1990-03-20 US disclosed
EP-0357739-A1 CHIRAL DERIVATIVES OF 1,2-DIFLUOROBENZENE MERCK PATENT GmbH (DE) 1990-03-14 EP disclosed
WO-1989008639-A1 CHIRAL DERIVATIVES OF 1,2-DIFLUOROBENZENE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 WO disclosed
EP-0332025-A1 Chiral derivatives of 1,2-difluorobenzenes MERCK PATENT GmbH (DE) 1989-09-13 EP disclosed
EP-0306919-A2 Liquid crystalline compounds and process for production thereof DAISO CO., LTD. (JP) 1989-03-15 EP disclosed
EP-0278665-A2 2-Substituted-alkyl ether and liquid crystal composition Chisso Corporation (JP) 1988-08-17 EP disclosed
EP-0168683-A2 Liquid crystals with alkenyl or alkenyloxy groups F. HOFFMANN-LA ROCHE AG (CH) 1986-01-22 EP disclosed
US-4487954-A LIQUID CRYSTALS CHISSO CORPORATION (JP) 1984-12-11 US disclosed
EP-0056113-A1 Cyclohexylcarbonitrile derivatives, dielectrics and electro-optic display device containing them MERCK PATENT GmbH (DE) 1982-07-21 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 (1 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-10581022-B2 Polymerizable liquid crystal compound, composition, liquid crystal polymerization film-kind thereof and use thereof RCC1, CHRM1, PFN1 ESR2 4809/4885ESR1 4691/4885CYP2C9 2312/4885

“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.