SCHEMBL7938536

SCHEMBL7938536

O=C(NCC(F)C(F)F)NCC(F)C(F)F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.33

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
SCHEMBL5485259 0.81 CYP2D6 (0.50)
SCHEMBL7935567 0.79 BCAT2 (0.39)
Hydrochloric Acid SCHEMBL29241688 0.74 MMP2 (0.40)
Hydrochloric Acid SCHEMBL29241555 0.71 MMP2 (0.44)
Hydrochloric Acid SCHEMBL29241518 0.68 MMP2 (0.40)
SCHEMBL5064628 0.67 EPHX1 (0.31) EPHX1
SCHEMBL4588239 0.67 EPHX1 (0.38) EPHX1
SCHEMBL29026611 0.65
SCHEMBL1275889 0.65 CYP2D6 (0.65) EPHX1
SCHEMBL22635735 0.64 EPHX1 (0.36) EPHX1

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-6218498-B1 USEFUL IN PREPARING MOISTURE CURABLE RTV-1 COMPOSITIONS, AND ARE USEFUL IN DIVERSE PROCESSES WHERE SCAVENGING OF PROTIC MATERIALS, PARTICULARLY WATER, IS DESIRED. WACKER-CHEMIE GMBH (DE) 2001-04-17 US disclosed