SCHEMBL5697977

SCHEMBL5697977

CCCCCCCCC1CCCOO1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.57
ALDH1A1 P00352 2/20 0.50
CYP1A2 P05177 4/20 0.43
RAD52 P43351 1/20 0.37
PPARG P37231 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
GRM2 Q14416 3/20 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
SCHEMBL28042955 1.00 EPHX1 (0.57) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL9419418 1.00 EPHX1 (0.57) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL27650515 1.00 EPHX1 (0.57) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL3271036 1.00 EPHX1 (0.57) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL12096491 0.98 EPHX1 (0.53) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL3081607 0.94 EPHX1 (0.55) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL3713923 0.93 EPHX1 (0.53) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL17474391 0.93 EPHX1 (0.53) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL3802705 0.93 EPHX1 (0.53) EPHX1ALDH1A1CYP1A2RAD52PPARG
SCHEMBL28426490 0.93 EPHX1 (0.53) EPHX1ALDH1A1CYP1A2RAD52PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670989-A1 POWDER COMPOSITION FOR PAPER MANUFACTURING Kao Corporation (JP) 2006-06-21 EP disclosed
WO-2005012636-A1 POWDER COMPOSITION FOR PAPER MANUFACTURING KAO CORPORATION (JP) 2005-02-10 WO disclosed