SCHEMBL15906240

SCHEMBL15906240

CCCCCCCNC(=O)N(CCC)CCN

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.48
RRM1 P23921 1/20 0.47
GNAI3 P08754 1/20 0.45
GNAO1 P09471 1/20 0.45
GNAI1 P63096 1/20 0.45
DPP7 Q9UHL4 1/20 0.45
CASP2 P42575 1/20 0.44
SLC6A5 Q9Y345 2/20 0.43
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
NAAA Q02083 1/20 0.42
EPHX2 P34913 2/20 0.42
PAOX Q6QHF9 2/20 0.42
DNM1 Q05193 1/20 0.41

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
SCHEMBL13190887 0.97 PAOX (0.44) EPHX1RRM1GNAI3GNAO1GNAI1
SCHEMBL25229275 0.91 EPHX1 (0.57) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL25225480 0.91 EPHX1 (0.57) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL30433355 0.91 EPHX1 (0.57) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL25271720 0.91 EPHX1 (0.57) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL25278109 0.91 EPHX1 (0.57) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL25270387 0.91 EPHX1 (0.57) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL25225603 0.91 EPHX1 (0.57) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL25272126 0.89 EPHX1 (0.54) EPHX1DPP7CASP2ZDHHC20ZDHHC2
SCHEMBL3208896 0.88 PAOX (0.47) EPHX1RRM1GNAI3GNAO1GNAI1

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-8791222-B2 Polymeric dye for optical power limiting OXAZOGEN, INC. (US) 2014-07-29 US disclosed