SCHEMBL28364

SCHEMBL28364

OCC(O)c1cc[c]cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
LMNA P02545 1/20 0.34
TAAR1 Q96RJ0 3/20 0.33
KDM4E B2RXH2 3/20 0.33
HIF1A Q16665 2/20 0.33
NFKB1 P19838 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTR3A P46098 1/20 0.33
PLAU P00749 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
ALOX15 P16050 1/20 0.32
APEX1 P27695 1/20 0.32
AOC3 Q16853 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
ALDH1A1 P00352 1/20 0.30
HTR1A P08908 1/20 0.30
THPO P40225 1/20 0.30
BLM P54132 1/20 0.30
NMUR2 Q9GZQ4 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
SCHEMBL6274882 0.81 RIPK1 (0.35) TSHRLMNATAAR1KDM4EHIF1A
SCHEMBL17438169 0.81 TSHR (0.48) TSHRCYP3A4LMNATAAR1KDM4E
SCHEMBL317586 0.78 LMNA (0.60) TSHRCYP3A4LMNATAAR1KDM4E
SCHEMBL19468908 0.78 LMNA (0.38) TSHRLMNATAAR1KDM4EHIF1A
SCHEMBL19206601 0.78 TAAR1 (0.58) TSHRCYP3A4LMNATAAR1KDM4E
SCHEMBL22363024 0.78 LMNA (0.33) TSHRLMNATAAR1KDM4EHIF1A
SCHEMBL21750404 0.75 TAAR1 (0.39) TSHRLMNATAAR1KDM4EHIF1A
SCHEMBL22399245 0.75 LMNA (0.40) LMNATAAR1KDM4EHIF1AL3MBTL1
SCHEMBL317303 0.75 LMNA (0.40) LMNATAAR1KDM4EHIF1AL3MBTL1
SCHEMBL3598848 0.75 AOC3 (0.36) TSHRLMNATAAR1KDM4EHIF1A

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

Appears in 2959 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024141554-A1 COMPOUNDS AFFECTING KRAS UNIVERSITAT DE BARCELONA (ES) 2024-07-04 WO claimed
EP-4393908-A1 BIS-PYRAZOLYL-METHANE COMPOUNDS AFFECTING KRAS Universitat de Barcelona (ES) 2024-07-03 EP claimed
CN-117683014-A Thioxanthone photoinitiator containing chalcone structure and preparation and application thereof 大连理工大学 2024-03-12 CN claimed
US-20160362427-A1 BRIDGED BICYCLIC KALLIKREIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2016-12-15 US claimed
CN-103313970-B Novel bicyclic compound or salt thereof 大鹏药品工业株式会社 2016-09-07 CN claimed
WO-2014074628-A1 COMPOUNDS FOR TREATING HIV AND METHODS FOR USING THE COMPOUNDS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2014-05-15 WO claimed
US-20130261130-A1 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2013-10-03 US claimed
EP-2635559-A2 NEUROTRYPSIN INHIBITORS Neurotune AG (CH) 2013-09-11 EP claimed
CN-101282949-B Azole and thiazole derivatives and uses thereof ARGENTA DISCOVERY LTD 2012-05-23 CN claimed
WO-2012059442-A2 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2012-05-10 WO claimed
WO-1993016986-A1 AZO OXIME ETHERS AND THEIR USE AS FUNGICIDES CIBA-GEIGY AG (CH) 1993-09-02 WO claimed
US-5019587-A Anticoagulants BOEHRINGER MANNHEIM GMBH (DE) 1991-05-28 US claimed
EP-0218689-B1 ANTHELMINTIC QUINOLINYL ACYLHYDRAZONES AND COMPOSITIONS THE UPJOHN COMPANY (US) 1990-08-01 EP claimed
EP-0263209-A2 Anthelmintic quinolinyl acylhydrazones THE UPJOHN COMPANY (US) 1988-04-13 EP claimed
US-4140681-A ANTICOAGULANTS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1979-02-20 US claimed
US-4131673-A INHIBITION AND SUPPRESSION OF THROMBOSIS IN MAMMALS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1978-12-26 US claimed
US-4125604-A PEPTIDES, ANTITHROMBOSIS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1978-11-14 US claimed
US-4101653-A ANTITHROMBOSIS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1978-07-18 US claimed
US-4093712-A ANTITHROMBOGENIC AGENTS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JA) 1978-06-06 US claimed
US-4066773-A ANTITHROMBOSIS MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) 1978-01-03 US claimed