SCHEMBL690676

SCHEMBL690676

Cc1cc(C(=O)O)c(CCCCCc2ccccc2C(=O)O)c(C)c1C

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 10/20 0.55
FOLH1 Q04609 1/20 0.47
DHODH Q02127 1/20 0.44
HTT P42858 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
CRHBP P24387 1/20 0.38
KMT2A Q03164 1/20 0.38
CRHR2 Q13324 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL9345842 0.81 FOLH1 (0.68) SLC16A3FOLH1DHODHALDH1A1
SCHEMBL729909 0.79 FOLH1 (0.70) SLC16A3FOLH1DHODHALDH1A1KDM4E
Methylamine SCHEMBL7717879 0.77 BID (0.56) SLC16A3FOLH1
Methylamine SCHEMBL7716905 0.77 BID (0.56) SLC16A3FOLH1
SCHEMBL1562330 0.77 BID (0.59) SLC16A3FOLH1ALDH1A1
SCHEMBL586009 0.77 BID (0.59) SLC16A3FOLH1ALDH1A1
SCHEMBL1691931 0.77 BID (0.59) SLC16A3FOLH1ALDH1A1
SCHEMBL5710015 0.77 BID (0.59) SLC16A3FOLH1ALDH1A1
SCHEMBL8925891 0.77 BID (0.59) SLC16A3FOLH1ALDH1A1
SCHEMBL467028 0.77 BID (0.59) SLC16A3FOLH1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2025318-B1 Two-phase composition for conditioning hair KAO GERMANY GMBH (DE) 2018-07-25 EP claimed
EP-2288416-B2 HYDROALCOHOLIC GEL COMPOSITIONS FOR USE WITH DISPENSERS GOJO IND INC (US) 2014-12-24 EP claimed
EP-2288416-B1 HYDROALCOHOLIC GEL COMPOSITIONS FOR USE WITH DISPENSERS GOJO IND INC (US) 2012-02-29 EP claimed