SCHEMBL7158307

SCHEMBL7158307

CCCCCCCCCCCCC(CC)C(Oc1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.47
PPARA Q07869 7/20 0.46
PPARG P37231 5/20 0.46
ALOX5 P09917 2/20 0.46
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CNR2 P34972 1/20 0.43
FAAH O00519 6/20 0.41
PTGES O14684 1/20 0.41

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
SCHEMBL19127531 1.00 CTRC (0.47) CTRCPPARAPPARGALOX5PRSS1
SCHEMBL9848547 0.90 PPARA (0.47) CTRCPPARAPPARGALOX5ALDH1A1
SCHEMBL28908651 0.86 KMT2A (0.46) PPARAPPARGALOX5ALDH1A1FAAH
SCHEMBL23566860 0.84 CTRC (0.51) CTRCPPARAPPARGALOX5PRSS1
SCHEMBL18259710 0.84 CTRC (0.51) CTRCPPARAPPARGALOX5PRSS1
SCHEMBL28558780 0.83 CTRC (0.47) CTRCPPARAPPARGALOX5PRSS1
SCHEMBL664608 0.82 CTRC (0.46) CTRCPPARAPPARGALOX5ALDH1A1
SCHEMBL4748765 0.82 CTRC (0.46) CTRCPPARAPPARGALOX5ALDH1A1
SCHEMBL11531304 0.79 CTRC (0.64) CTRCPPARAPPARGALOX5ALDH1A1
SCHEMBL22828775 0.79 CTRC (0.64) CTRCPPARAPPARGALOX5ALDH1A1

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
US-6552107-B1 For use in electrostatic dissipation to electrochromic displays such as use in antistatic ESD coatings, absorption of radar frequencies, corrosion prevention, EMI/RFI shielding, electrochemical actuators, lithographic resists lightning COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2003-04-22 US disclosed