SCHEMBL4155154

SCHEMBL4155154

COc1cc(CCCCCCCCCC=CCCCCCCCC(N)=O)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.64
TRPV1 Q8NER1 6/20 0.62
CYP1A2 P05177 5/20 0.62
CYP3A4 P08684 5/20 0.62
ALOX5 P09917 4/20 0.62
CYP2D6 P10635 3/20 0.62
CYP2C9 P11712 3/20 0.62
CYP2C19 P33261 3/20 0.62
LTA4H P09960 3/20 0.62
CYP2C8 P10632 2/20 0.62
CYP2B6 P20813 2/20 0.62
CYP2E1 P05181 1/20 0.62
CYP2A6 P11509 1/20 0.62
MEN1 O00255 2/20 0.60
TP53 P04637 2/20 0.60
MAPT P10636 2/20 0.60
KMT2A Q03164 2/20 0.60
HPGD P15428 1/20 0.60
MTOR P42345 1/20 0.60
ALDH1A1 P00352 2/20 0.55

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
SCHEMBL5353374 0.95 HTR1A (0.61) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL2683415 0.92 ALOX5 (0.66) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL28378162 0.92 ALOX5 (0.66) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL11575857 0.92 ALOX5 (0.66) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL906528 0.91 ALOX5 (0.67) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL5723843 0.87 ALOX5 (0.66) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL5351456 0.86 TAAR1 (0.66) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL6635889 0.84 TRPV1 (0.60) HTR1ATRPV1CYP1A2CYP3A4ALOX5
SCHEMBL5192275 0.82 KDM4E (0.57) ALOX5KDM4E
SCHEMBL5724212 0.82 ALOX5 (0.72) HTR1ATRPV1CYP1A2CYP3A4ALOX5

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
US-20090042946-A1 METHOD AND KIT FOR CONTROLLING BLEEDING MOORE II BOB M 2009-02-12 US disclosed
EP-1635689-A4 METHOD AND KIT FOR CONTROLLING BLEEDING UNIV TENNESSEE RES FOUNDATION (US) 2008-10-15 EP disclosed
EP-1635689-A2 METHOD AND KIT FOR CONTROLLING BLEEDING University of Tennessee Research Foundation (US) 2006-03-22 EP disclosed
US-6864285-B1 Hypotensive agents; antihistamines; immunology moderators; antiinflammatory agents INNOVET ITALIA S.R.L. (IT) 2005-03-08 US disclosed
WO-2004093664-A2 METHOD AND KIT FOR CONTROLLING BLEEDING UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2004-11-04 WO disclosed
US-20040202735-A1 Method and kit for controlling bleeding UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2004-10-14 US disclosed