SCHEMBL5333967

SCHEMBL5333967

CCCC/C=C\CCCC1CCCC(=O)O1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.58
PPARG P37231 2/20 0.42
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
EPHX2 P34913 1/20 0.36
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
TP53 P04637 1/20 0.34
CCR6 P51684 1/20 0.34

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
SCHEMBL18339149 1.00 CYP1A2 (0.58) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL18339184 0.91 CYP1A2 (0.50) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL15067478 0.90 CYP1A2 (0.56) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL918003 0.87 CYP1A2 (0.69) CYP1A2PPARGALDH1A1TP53
SCHEMBL9192649 0.85 CYP1A2 (0.77) CYP1A2PPARGALDH1A1
SCHEMBL114875 0.85 CYP1A2 (0.77) CYP1A2PPARGALDH1A1
SCHEMBL8167761 0.85 CYP1A2 (0.77) CYP1A2PPARGALDH1A1
SCHEMBL31047999 0.84 CYP1A2 (0.66) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL17987905 0.84 CYP1A2 (0.49) CYP1A2PPARGALDH1A1TSHR
SCHEMBL31048000 0.84 CYP1A2 (0.66) CYP1A2PPARGALDH1A1TSHREPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063998-A LED (light-emitting diode) cured tin printing black ink 广东然顿环保新材料有限公司 2024-05-24 CN disclosed
JP-2007091663-A (Z)-9-TETRADECEN-5-OLIDE, METHOD FOR PRODUCING THE SAME AND PERFUME COMPOSITION CONTAINING THE SAME SHIONO KORYO KK 2007-04-12 JP disclosed