SCHEMBL6436922

SCHEMBL6436922

CCCC/C=C/CCC(C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.53
F7 P08709 2/20 0.50
F3 P13726 2/20 0.50
CNR1 P21554 5/20 0.49
TERT O14746 3/20 0.46
MAPT P10636 2/20 0.46
BLM P54132 2/20 0.46
HSD17B10 Q99714 2/20 0.46
FABP4 P15090 2/20 0.46
PTPN1 P18031 2/20 0.46
PPARG P37231 2/20 0.46
PPARD Q03181 2/20 0.46
PPARA Q07869 2/20 0.46
GMNN O75496 1/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
CYP2C9 P11712 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL28572541 1.00 ACE2 (0.53) ACE2F7F3CNR1TERT
SCHEMBL6436924 1.00 ACE2 (0.53) ACE2F7F3CNR1TERT
SCHEMBL17583505 0.92 ACE2 (0.59) ACE2F7F3CNR1TERT
SCHEMBL6436799 0.92 ACE2 (0.59) ACE2F7F3CNR1TERT
SCHEMBL6436797 0.92 ACE2 (0.59) ACE2F7F3CNR1TERT
SCHEMBL6436549 0.92 ACE2 (0.59) ACE2F7F3CNR1TERT
SCHEMBL17583506 0.92 ACE2 (0.59) ACE2F7F3CNR1TERT
SCHEMBL6437153 0.92 ACE2 (0.59) ACE2F7F3CNR1TERT
SCHEMBL11286250 0.90 ACE2 (0.56) ACE2F7F3TERTMAPT
SCHEMBL29199500 0.90 ACE2 (0.56) ACE2F7F3TERTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1230207-B1 METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS PEDERSON RICHARD L (US) 2005-06-22 EP claimed