SCHEMBL193834

SCHEMBL193834

[O]CC(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.52
TAAR1 Q96RJ0 1/20 0.52
HRH1 P35367 5/20 0.48
TDP1 Q9NUW8 1/20 0.44
CYP2D6 P10635 1/20 0.43
SRC P12931 1/20 0.43
DPP4 P27487 2/20 0.43
F2 P00734 1/20 0.43
TSHR P16473 1/20 0.43
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
LMNA P02545 2/20 0.42
MTOR P42345 1/20 0.42
RAB9A P51151 1/20 0.42
GRM7 Q14831 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL4275218 0.79 GABBR2 (0.46) HTR2ATAAR1HRH1CYP2D6SRC
SCHEMBL4282489 0.77 CES2 (0.42) HTR2ATAAR1HRH1CYP2D6SRC
SCHEMBL2096306 0.77 HRH1 (0.56) HTR2ATAAR1HRH1CYP2D6LMNA
SCHEMBL94275 0.75 HTR2A (0.52) HTR2ATAAR1HRH1TDP1DPP4
SCHEMBL7331209 0.75 HTR2A (0.52) HTR2ATAAR1HRH1TDP1DPP4
SCHEMBL8609744 0.75 TSHR (0.50) HTR2ATAAR1HRH1CYP2D6SRC
SCHEMBL9327547 0.75 LMNA (0.58) LMNARAB9AMAPK1
SCHEMBL709925 0.75 TAAR1 (0.58) TAAR1
SCHEMBL9838705 0.73 HTR2A (0.58) HTR2ATAAR1HRH1TDP1DPP4
SCHEMBL3290730 0.73 HRH1 (0.68) HTR2ATAAR1HRH1TDP1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184973-A Multifunctional CO2Base copolyester and preparation method thereof 青岛科技大学 2024-06-14 CN claimed
CN-116375993-A Simple method for preparing high molecular weight modifiable copolyester 青岛科技大学 2023-07-04 CN claimed
CN-118206733-A Controllable preparation method of high molecular weight polylactic acid 青岛科技大学 2024-06-18 CN disclosed
US-20230322669-A1 METHOD FOR PRODUCING PYRROLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-12 US disclosed
EP-4257577-A2 METHOD FOR PRODUCING PYRROLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2023-10-11 EP disclosed
US-11649206-B2 Method for producing pyrrole compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-05-16 US disclosed
US-20230143246-A1 LIQUID PREPARATIONS OF AMINES AND ORGANIC ACIDS STABILIZED BY SALTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-05-11 US disclosed
US-20230088365-A1 PROCESS FOR PRODUCING PYRROLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-03-23 US disclosed
US-20220411449-A1 Method for Preparing Heteroleptic Triarylbismuthanes and Compounds Produced by the Same UNIVERSITY OF HAWAII 2022-12-29 US disclosed
CN-114276524-A Preparation method of high-molecular-weight degradable recyclable polyester containing double-bond side groups 青岛科技大学 2022-04-05 CN disclosed
US-11254700-B2 GSK-3β inhibitors and use thereof in methods of treatment UNIVERSITY OF HAWAII (US) 2022-02-22 US disclosed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 WO disclosed
EP-1063235-A1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LIMITED (JP) 2000-12-27 EP disclosed
EP-0868224-A1 HEAT ABLATIVE COATING COMPOSITION Ameron International Corporation (US) 1998-10-07 EP disclosed
US-5703178-A Heat ablative coating composition AMERON INTERNATIONAL CORPORATION (US) 1997-12-30 US disclosed
WO-1997019764-A1 HEAT ABLATIVE COATING COMPOSITION AMERON INTERNATIONAL CORPORATION (US) 1997-06-05 WO disclosed
EP-0441226-A1 (cyanomethyl)pyridines useful as PAF antagonists J. URIACH & CIA. S.A. (ES) 1991-08-14 EP disclosed
US-4359404-A Hydrogenation of esters using alkali doped heterogeneous Group VIII transition metal catalysts ALLIED CORPORATION (US) 1982-11-16 US disclosed
US-4346240-A Hydrogenation of esters using alkali doped heterogeneous group VIII transition metal catalysts ALLIED CORPORATION (US) 1982-08-24 US disclosed
EP-0036939-A1 Hydrogenation of esters using alkali doped heterogeneous group VIII transition metal catalysts ALLIED CORPORATION (US) 1981-10-07 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 (6 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-20220411449-A1 Method for Preparing Heteroleptic Triarylbismuthanes and Compounds Produced by the Same COASY, HAGH, MRM1 HTR2A 4394/4885TAAR1 2287/4885HRH1 2687/4885
US-20230088365-A1 PROCESS FOR PRODUCING PYRROLE COMPOUND DHPS, STS, HPD HTR2A 2670/4885TAAR1 4240/4885HRH1 1851/4885
US-11254700-B2 GSK-3β inhibitors and use thereof in methods of treatment GSK3B, GSK3A, GSKIP HTR2A 3317/4885TAAR1 4549/4885HRH1 4208/4885
US-20230143246-A1 LIQUID PREPARATIONS OF AMINES AND ORGANIC ACIDS STABILIZED BY SALTS OTC, SLC38A7, SRI HTR2A 416/4885TAAR1 314/4885HRH1 171/4885
US-20230322669-A1 METHOD FOR PRODUCING PYRROLE COMPOUND HPD, PPOX, CBR3 HTR2A 2083/4885TAAR1 3649/4885HRH1 68/4885
US-11649206-B2 Method for producing pyrrole compound HPD, PPOX, CBR3 HTR2A 2083/4885TAAR1 3649/4885HRH1 68/4885

“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.