SCHEMBL8950425

SCHEMBL8950425

C#CCCC=C(C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD81 P60033 2/20 0.37
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
PPARG P37231 1/20 0.33
BACE1 P56817 1/20 0.31

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
SCHEMBL8950422 1.00 CD81 (0.37) CD81CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL5362246 0.84 MAPT (0.47) CD81CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL23749600 0.81 KDM4E (0.30) KDM4EALDH1A1HPGD
SCHEMBL234427 0.78 MEN1 (0.38) CD81ALDH1A1PPARGBACE1
SCHEMBL2049619 0.78 MEN1 (0.38) CD81ALDH1A1PPARGBACE1
SCHEMBL1765494 0.78 CD81 (0.44) CD81CYP2C9KDM4EPPARGBACE1
SCHEMBL129059 0.78 CD81 (0.44) CD81CYP2C9KDM4EPPARGBACE1
SCHEMBL2147310 0.77
SCHEMBL699232 0.77
SCHEMBL7279044 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012065065-A9 METHODS AND COMPOSITIONS FOR MODULATING HAIR GROWTH, WOUND HEALING AND SCAR REVISION FOLLICA, INC. (US) 2012-10-11 WO disclosed
US-5502073-A INSECTICIDES OR ANTHELMINTICS THE WELLCOME FOUNDATION (GB) 1996-03-26 US disclosed
EP-0294229-B1 NOVEL HETEROCYCLIC PESTICIDAL COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1992-12-02 EP disclosed
EP-0294229-A2 Novel heterocyclic pesticidal compounds THE WELLCOME FOUNDATION LIMITED (GB) 1988-12-07 EP disclosed