SCHEMBL10876403

SCHEMBL10876403

CCCCCCCCCCCCCC1CCO1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 1.00
ALDH1A1 P00352 2/20 0.67
CYP1A2 P05177 3/20 0.50
TDP1 Q9NUW8 1/20 0.45
RAD52 P43351 1/20 0.41
SPHK1 Q9NYA1 5/20 0.40
SPHK2 Q9NRA0 4/20 0.40
PPARG P37231 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL27811788 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL30614496 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL11122975 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL25303980 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL12956511 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL25262887 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL6359431 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL25304106 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL2731115 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52
SCHEMBL27832071 1.00 EPHX1 (1.00) EPHX1ALDH1A1CYP1A2TDP1RAD52

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-0204039-A1 Borated, hydrolyzed epoxides and lubricant compositions containing them MOBIL OIL CORPORATION (US) 1986-12-10 EP disclosed
US-4522734-A Borated friction reducing additives and compositions thereof MOBIL OIL CORPORATION (US) 1985-06-11 US disclosed