SCHEMBL9406316

SCHEMBL9406316

CCCCCC1CCC(C2CCC(CO)CC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.45
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
PKM P14618 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TP53 P04637 1/20 0.39
LSS P48449 2/20 0.38
MAPT P10636 1/20 0.38
GBA1 P04062 4/20 0.37
EPHX1 P07099 1/20 0.36

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
SCHEMBL9406324 1.00 CYP1A2 (0.45) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL3268776 1.00 CYP1A2 (0.45) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL17431971 1.00 CYP1A2 (0.45) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL12675265 1.00 CYP1A2 (0.45) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL9406573 0.98 CYP1A2 (0.43) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL9406587 0.98 CYP1A2 (0.43) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL9406580 0.98 CYP1A2 (0.43) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL9406547 0.98 CYP1A2 (0.43) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL9406554 0.98 CYP1A2 (0.43) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL9406542 0.98 CYP1A2 (0.43) CYP1A2HTTLMNAMAPK1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3924447-B1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2024-01-24 EP disclosed
US-11072742-B2 Liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2021-07-27 US disclosed
US-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 US disclosed
US-10647921-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2020-05-12 US disclosed
EP-3275973-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2019-12-18 EP disclosed
US-10479940-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-11-19 US disclosed
EP-3257839-B1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2019-09-04 EP disclosed
US-10392339-B2 Polymerizable polar compound, liquid crystal composition, and liquid crystal display element JNC CORPORATION (JP) 2019-08-27 US disclosed
US-20190185754-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2019-06-20 US disclosed
US-10234728-B2 Liquid crystal display device and method of manufacturing the same SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-19 US disclosed
US-20140138581-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-05-22 US disclosed
US-20140138581-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-05-22 US disclosed
US-8580142-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-11-12 US disclosed
WO-2013004372-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2013-01-10 WO disclosed
US-20100328600-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-30 US disclosed
EP-0355552-B1 Alkoxymethyl- and alkenyloxymethyl-cyclohexanes HOFFMANN LA ROCHE (CH) 1994-02-23 EP disclosed
US-5102578-A Electrooptics HOFFMANN-LA ROCHE INC. (US) 1992-04-07 US disclosed
EP-0355552-A2 Alkoxymethyl- and alkenyloxymethyl-cyclohexanes F. HOFFMANN-LA ROCHE AG (CH) 1990-02-28 EP disclosed
WO-1989011496-A1 SIDE-CHAIN POLYMERS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-11-30 WO disclosed
WO-1988009322-A1 CYCLOBUTANE DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1988-12-01 WO 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-10392339-B2 Polymerizable polar compound, liquid crystal composition, and liquid crystal display element SP1, HVCN1, CXCR1 CYP1A2 2616/4885HTT 4549/4885LMNA 1014/4885
US-20100328600-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, MARK3, CCND3 CYP1A2 3613/4885HTT 1890/4885LMNA 2081/4885

“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.