SCHEMBL8380351

SCHEMBL8380351

CNCCCN.CO[SiH](OC)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.39
CASP2 P42575 2/20 0.36
CA12 O43570 2/20 0.36
F13A1 P00488 2/20 0.36
CA2 P00918 2/20 0.36
CYP1A2 P05177 2/20 0.36
ALOX15 P16050 2/20 0.36
CA4 P22748 2/20 0.36
CA6 P23280 2/20 0.36
CA5A P35218 2/20 0.36
THPO P40225 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA14 Q9ULX7 2/20 0.36
CA5B Q9Y2D0 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL137956 0.91 EPHX1 (0.46) EPHX1CA12F13A1CA2CYP1A2
SCHEMBL131936 0.85 CA12 (0.32) EPHX1CA12CA2ALOX15CA4
SCHEMBL27121 0.82
SCHEMBL12501988 0.82 CA12 (0.50) EPHX1CASP2CA12F13A1CA2
SCHEMBL612563 0.80 EPHX1 (0.55) EPHX1CA12CA2CA7CA14
Butane SCHEMBL28110601 0.79 EPHX1 (0.52) EPHX1CASP2CA12F13A1CA2
Hydrochloric Acid SCHEMBL4717644 0.79
Ammonia Solution, Strong SCHEMBL16346386 0.79
Ethylenediamine SCHEMBL20582708 0.79 CA12 (0.47) EPHX1CASP2CA12F13A1CA2
SCHEMBL7886703 0.79

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
EP-0721001-B1 Two-pack aqueous adhesive cross-linked by amino siloxanes SUNSTAR ENGINEERING INC (JP) 1999-04-14 EP disclosed