SCHEMBL19985154

SCHEMBL19985154

C=CCCCCCCCSCC(=C)c1ccc2c(c1)CC(=C)N2

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.32

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
SCHEMBL22907692 0.86 ESR1 (0.36) EPHX2
SCHEMBL22907539 0.85 EPHX2 (0.30) EPHX2
SCHEMBL22907478 0.80 EPHX2 (0.35) EPHX2
SCHEMBL13854228 0.75 EPHX2 (0.42) EPHX2
SCHEMBL13854238 0.71 EPHX2 (0.46) EPHX2
SCHEMBL18651737 0.68 EPHX2 (0.46) EPHX2
SCHEMBL13854220 0.65 EPHX2 (0.44) EPHX2
SCHEMBL4198695 0.62 EPHX2 (0.57) EPHX2
SCHEMBL13854232 0.60 SMYD3 (0.32)
SCHEMBL28345621 0.58 MAOA (0.39)

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-2944310-B1 MIF inhibitors for the acute or chronic treatment of pulmonary hypertension MIFCARE (FR) 2018-03-21 EP disclosed