SCHEMBL28870686

SCHEMBL28870686

CCCCCCCCNC(=S)SSC(N)=S

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.44
KDM4A O75164 1/20 0.43
CASP2 P42575 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
NAAA Q02083 1/20 0.38
SPHK1 Q9NYA1 3/20 0.37

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
SCHEMBL28186682 1.00 EPHX1 (0.44) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL11212577 1.00 EPHX1 (0.44) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL30957958 1.00 EPHX1 (0.44) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL28218765 1.00 EPHX1 (0.44) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL22471734 1.00 EPHX1 (0.44) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL28186673 1.00 EPHX1 (0.44) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL28185968 1.00 EPHX1 (0.44) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL3654082 0.92 KDM4A (0.46) EPHX1KDM4A
SCHEMBL381501 0.90 KDM4A (0.52) EPHX1KDM4ACASP2ZDHHC20ZDHHC2
SCHEMBL3271166 0.90 KDM4A (0.52) EPHX1KDM4ACASP2ZDHHC20ZDHHC2

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
CN-107406632-B Rubber composition and tire 株式会社普利司通 2019-03-01 CN disclosed