SCHEMBL446430

SCHEMBL446430

CCCCc1ccc(OP(O)Oc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.48
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.46
FFAR1 O14842 3/20 0.44
LMNA P02545 2/20 0.43
GAA P10253 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
ALOX12 P18054 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
LTA4H P09960 1/20 0.43
HSD11B1 P28845 1/20 0.43
RARB P10826 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL28044881 0.94 ALDH1A1 (0.50) TRPV1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL9651434 0.94 ALDH1A1 (0.50) TRPV1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL28378039 0.93 CA1 (0.48) ALDH1A1HPGDHSD17B10LMNAGAA
SCHEMBL10348762 0.88 ALDH1A1 (0.53) TRPV1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL317709 0.86 ALDH1A1 (0.56) TRPV1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL8433697 0.86 ALDH1A1 (0.56) TRPV1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL8372837 0.86 ALDH1A1 (0.56) TRPV1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL1021217 0.86 LTA4H (0.46) TRPV1ALDH1A1HPGDHSD17B10CA1
SCHEMBL28340889 0.86 ALDH1A1 (0.56) TRPV1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL5600659 0.86 ALDH1A1 (0.56) TRPV1ALDH1A1HSD17B10LMNAMEN1

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-20120065112-A1 LUBRICANT COMPOSITION WITH IMPROVED VARNISH DEPOSIT RESISTANCE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2012-03-15 US disclosed