SCHEMBL1509720

SCHEMBL1509720

Oc1ccccc1C1CCC(O)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.47
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
CA12 O43570 1/20 0.38
GMNN O75496 1/20 0.38
ALDH1A1 P00352 1/20 0.38
EGFR P00533 1/20 0.38
CA2 P00918 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL1509721 1.00 ESR2 (0.47) ESR2MEN1KMT2AHTR2AHTR2C
SCHEMBL3992205 0.91 MEN1 (0.50) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL929830 0.91 MEN1 (0.50) MEN1KMT2AHTR2AHTR2CHTR2B
Acrylic Acid SCHEMBL28334531 0.85 MEN1 (0.38) ESR2MEN1KMT2AMAPTKDM4E
SCHEMBL2271058 0.83 ESR2 (0.44) ESR2MEN1KMT2AMAPTKDM4E
SCHEMBL2047882 0.82 MEN1 (0.52) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL42554 0.82 KMT2A (0.57) MEN1KMT2AHTR2AHTR2CHTR2B
Catechol SCHEMBL16584581 0.81 ALDH1A1 (0.59) ESR2MEN1KMT2ACHRM2CHRM4
SCHEMBL28428015 0.81 ESR2 (0.48) ESR2MEN1KMT2AHTR2AHTR2C
SCHEMBL5428628 0.81 ESR2 (0.48) ESR2MEN1KMT2AHTR2AHTR2C

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111788505-B Composition for forming anisotropic dye film, and optical element 三菱化学株式会社 2022-10-04 CN disclosed
CN-111788505-A Composition for forming anisotropic dye film, and optical element 三菱化学株式会社 2020-10-16 CN disclosed
CN-110475827-A Radiation-curable composition for ink, printing product and its application method KAO CORP 2019-11-19 CN disclosed
WO-2019181888-A1 COMPOSITION FOR FORMING ANISOTROPIC DYE FILM, ANISOTROPIC DYE FILM AND OPTICAL ELEMENT 三菱ケミカル株式会社 2019-09-26 WO disclosed
CN-107473969-A The manufacture method of substrate with the driving liquid crystal orientation film used for liquid crystal display element of horizontal component of electric field 日产化学工业株式会社 2017-12-15 CN disclosed
CN-104903785-B Method for manufacturing substrate having liquid crystal alignment film for horizontal electric field drive type liquid crystal display element 日产化学工业株式会社 2017-08-15 CN disclosed
CN-102046584-B Compound, polymerizable liquid crystal composition, optical element, and optical information recording/reproducing device ASAHI GLASS CO LTD 2014-01-22 CN disclosed
US-8039064-B2 Compound, polymerizable liquid crystal composition, optical element and optical information writing/reading device ASAHI GLASS COMPANY, LIMITED (JP) 2011-10-18 US disclosed
US-20110063966-A1 COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, OPTICAL ELEMENT AND OPTICAL INFORMATION WRITING/READING DEVICE ASAHI GLASS COMPANY, LIMITED (JP) 2011-03-17 US disclosed
EP-2295396-A1 COMPOUND, POLYMERIZABLE LIQUID CRYSTALLINE COMPOSITION, OPTICAL ELEMENT, AND OPTICAL INFORMATION RECORDING/REPRODUCTION DEVICE Asahi Glass Company, Limited (JP) 2011-03-16 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-20110063966-A1 COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, OPTICAL ELEMENT AND OPTICAL INFORMATION WRITING/READING DEVICE CRY2, NOXO1, CIT ESR2 3363/4885MEN1 4279/4885KMT2A 1763/4885

“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.