SCHEMBL11544996

SCHEMBL11544996

CCCCCCCCCCCCCCCCCSNC(N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 5/20 0.48
CES2 O00748 6/20 0.44
TP53 P04637 2/20 0.44
GMNN O75496 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
CYP2C9 P11712 1/20 0.44
BLM P54132 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CES1 P23141 7/20 0.39
FAAH O00519 5/20 0.39
PLA2G6 O60733 1/20 0.39
CA2 P00918 1/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
SOAT1 P35610 1/20 0.38
KMT2A Q03164 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
SCHEMBL28331671 1.00 EPHX1 (0.48) EPHX1CES2TP53GMNNPOLB
SCHEMBL199561 1.00 EPHX1 (0.48) EPHX1CES2TP53GMNNPOLB
SCHEMBL27347625 1.00 EPHX1 (0.48) EPHX1CES2TP53GMNNPOLB
SCHEMBL4611729 1.00 EPHX1 (0.48) EPHX1CES2TP53GMNNPOLB
SCHEMBL8777414 1.00 EPHX1 (0.48) EPHX1CES2TP53GMNNPOLB
SCHEMBL28760871 1.00 EPHX1 (0.48) EPHX1CES2TP53GMNNPOLB
SCHEMBL7839954 1.00 EPHX1 (0.48) EPHX1CES2TP53GMNNPOLB
Hydrochloric Acid SCHEMBL10531008 0.98 EPHX1 (0.47) EPHX1CES2TP53GMNNPOLB
SCHEMBL561899 0.98 EPHX1 (0.46) EPHX1CES2TP53GMNNPOLB
SCHEMBL946019 0.91

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
US-4177072-A HYDROPHILIC AND OLEOPHILIC AREAS FUJI PHOTO FILM CO., LTD. (JP) 1979-12-04 US claimed
US-4177072-A HYDROPHILIC AND OLEOPHILIC AREAS FUJI PHOTO FILM CO., LTD. (JP) 1979-12-04 US disclosed