SCHEMBL8921829

SCHEMBL8921829

CCCCCCCc1ccc(CCCCCCC)o1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.57
PTGS1 P23219 2/20 0.49
PTGS2 P35354 2/20 0.49
ALOX5 P09917 2/20 0.49
MAPT P10636 1/20 0.47
ESR1 P03372 2/20 0.45
ADRA2A P08913 2/20 0.45
ADORA3 P0DMS8 2/20 0.45
TACR2 P21452 2/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45
SLC6A3 Q01959 2/20 0.45
KCNH2 Q12809 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
SHBG P04278 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
HSPD1 P10809 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
SCHEMBL3924849 1.00 EPHX2 (0.57) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL30889345 1.00 EPHX2 (0.57) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL10878735 1.00 EPHX2 (0.57) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL16753020 1.00 EPHX2 (0.57) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL3394938 0.97 EPHX2 (0.54) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL20860694 0.95 EPHX2 (0.54) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL12194495 0.95 EPHX2 (0.54) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL20877601 0.93 EPHX2 (0.53) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL18067898 0.93 EPHX2 (0.53) EPHX2PTGS1PTGS2ALOX5MAPT
SCHEMBL4312689 0.90 ALOX5 (0.47) EPHX2PTGS1PTGS2ALOX5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117881658-A Two-step synthesis of pyrrole compounds from furan compounds 切弗朗菲利浦化学公司 2024-04-12 CN disclosed
US-5618929-A INFRARED ABSORBING/VISIBLE WAVELENGTH TRANSPARENT; LANGMUIR-BLODGETT FILMS, LIQUID CRYSTAL DISPLAYS, OPTICAL RECORDING MEDIA THE SECRETARY OF STATE FOR DEFENCE IN HER BRITTANIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1997-04-08 US disclosed
US-5506708-A LIQUID CRYSTALS, LANGMUIR-BLODGETT FILMS THE SECRETARY OF STATE FOR DEFENCE IN HER MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1996-04-09 US disclosed
EP-0346354-B1 SUBSTITUTED PHTHALOCYANINES The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1992-08-19 EP disclosed
EP-0346354-A1 SUBSTITUTED PHTHALOCYANINES. SECR DEFENCE BRIT (GB) 1989-12-20 EP disclosed
WO-1988006175-A1 SUBSTITUTED PHTHALOCYANINES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNI (GB) 1988-08-25 WO disclosed