SCHEMBL6445257

SCHEMBL6445257

CCCCCCCCCCCCCCCCCCP(O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.41
HTT P42858 3/20 0.41
ALDH1A1 P00352 1/20 0.41
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
NAAA Q02083 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.39
JAK2 O60674 1/20 0.39
RAB9A P51151 1/20 0.39
PAX8 Q06710 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
DNM1 Q05193 1/20 0.38

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
SCHEMBL6443382 1.00 EPHX1 (0.41) EPHX1HTTALDH1A1CES2CES1
SCHEMBL6443841 1.00 EPHX1 (0.41) EPHX1HTTALDH1A1CES2CES1
SCHEMBL6441288 1.00 EPHX1 (0.41) EPHX1HTTALDH1A1CES2CES1
SCHEMBL7616017 0.83 CYP3A4 (0.38) CES2CES1KMT2A
SCHEMBL4416335 0.79 DNM1 (0.40) HTTCES2CES1NAAAMEN1
SCHEMBL3813028 0.79 DNM1 (0.40) HTTCES2CES1NAAAMEN1
SCHEMBL6288242 0.79 DNM1 (0.40) HTTCES2CES1NAAAMEN1
SCHEMBL49664 0.79 DNM1 (0.40) HTTCES2CES1NAAAMEN1
SCHEMBL6288656 0.79 DNM1 (0.40) HTTCES2CES1NAAAMEN1
SCHEMBL6288219 0.79 DNM1 (0.40) HTTCES2CES1NAAAMEN1

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-6956072-B1 Thermoplastic resin composition and molded object thereof POLYPLASTICS CO., LTD. (JP) 2005-10-18 US disclosed