SCHEMBL7770562

SCHEMBL7770562

CCCC(C)NC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.39
GAA P10253 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
SHBG P04278 1/20 0.34
RAB9A P51151 1/20 0.34
EPHX2 P34913 2/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SLC6A4 P31645 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL18844962 0.98 EPHX1 (0.42) EPHX1GAAL3MBTL1SMN1; SMN2MEN1
SCHEMBL172408 0.98 EPHX1 (0.42) EPHX1GAAL3MBTL1SMN1; SMN2MEN1
SCHEMBL6061582 0.98 EPHX1 (0.42) EPHX1GAAL3MBTL1SMN1; SMN2MEN1
SCHEMBL7776737 0.98 EPHX1 (0.42) EPHX1GAAL3MBTL1SMN1; SMN2MEN1
SCHEMBL2411184 0.91
SCHEMBL11057849 0.85 SIGMAR1 (0.40) EPHX1MEN1KMT2ACYP1A2SHBG
SCHEMBL25476883 0.84 EPHX1 (0.40) EPHX1GAAL3MBTL1SMN1; SMN2CYP2C9
SCHEMBL11057091 0.84 EPHX1 (0.41) EPHX1MEN1KMT2ACYP1A2EPHX2
SCHEMBL19593153 0.84 EPHX1 (0.41) EPHX1MEN1KMT2ACYP1A2EPHX2
SCHEMBL18520361 0.82 SIGMAR1 (0.44) EPHX1KMT2AALDH1A1EPHX2

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-0838508-B1 Aqueous ink composition for use in an ink-jet printer SEIKO EPSON CORP (JP) 2001-08-29 EP disclosed
US-5871572-A COLORANT, WATER, A WATER-SOLUBLE ORGANIC SOLVENT, AND PECTIC ACID SEIKO EPSON CORPORATION (JP) 1999-02-16 US disclosed
EP-0838508-A2 Aqueous ink composition for use in an ink-jet printer SEIKO EPSON CORPORATION (JP) 1998-04-29 EP disclosed