SCHEMBL5475404

SCHEMBL5475404

CCC(C)(C)N.CCCCCCCCC=CCCCCCCCCC1CCC(=O)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX2 P34913 1/20 0.39
TSHR P16473 1/20 0.35
FAAH O00519 4/20 0.35
MGLL Q99685 2/20 0.35
TRPV1 Q8NER1 1/20 0.34
CYP1A2 P05177 3/20 0.34
CYP2C19 P33261 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
SOAT1 P35610 1/20 0.34
KMT2A Q03164 1/20 0.34
HLCS P50747 1/20 0.33
S1PR2 O95136 1/20 0.32
S1PR4 O95977 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
S1PR5 Q9H228 1/20 0.32

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
Hydrochloric Acid SCHEMBL5493851 0.98 ALDH1A1 (0.38) ALDH1A1L3MBTL1EPHX2TSHRFAAH
SCHEMBL22201155 0.91 ALDH1A1 (0.46) ALDH1A1L3MBTL1EPHX2TSHRFAAH
SCHEMBL22201158 0.91 ALDH1A1 (0.46) ALDH1A1L3MBTL1EPHX2TSHRFAAH
SCHEMBL9646435 0.82 ALDH1A1 (0.53) ALDH1A1L3MBTL1CYP1A2MEN1KMT2A
SCHEMBL22201153 0.82 ALDH1A1 (0.53) ALDH1A1L3MBTL1CYP1A2MEN1KMT2A
SCHEMBL5175881 0.82 ALDH1A1 (0.53) ALDH1A1L3MBTL1CYP1A2MEN1KMT2A
SCHEMBL22190342 0.82 ALDH1A1 (0.53) ALDH1A1L3MBTL1CYP1A2MEN1KMT2A
SCHEMBL5872353 0.82 ALDH1A1 (0.53) ALDH1A1L3MBTL1CYP1A2MEN1KMT2A
SCHEMBL8051534 0.82 ALDH1A1 (0.53) ALDH1A1L3MBTL1CYP1A2MEN1KMT2A
SCHEMBL3503763 0.81 ALDH1A1 (0.50) ALDH1A1L3MBTL1CYP1A2MEN1KMT2A

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
US-7244698-B2 Viscoelastic surfactant composition having improved rheological properties and method of using for treating subterranean formations NALCO COMPANY (US) 2007-07-17 US disclosed
WO-2006020067-A2 VISCOELASTIC SURFACTANT COMPOSITION HAVING IMPROVED RHEOLOGICAL PROPERTIES AND METHOD OF USING FOR TREATING SUBTERRANEAN FORMATIONS NALCO COMPANY A DELAWARE CORPORATION (US) 2006-02-23 WO disclosed
US-20060025321-A1 Viscoelastic surfactant composition having improved rheological properties and method of using for treating subterranean formations ECOLAB USA INC. 2006-02-02 US disclosed