SCHEMBL9011408

SCHEMBL9011408

CCCCCCCCCCCCCCCCCCNc1ccc(NC)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.53
KCNH3 Q9ULD8 2/20 0.46
EPHX1 P07099 1/20 0.44
PRSS1 P07477 6/20 0.44
F2 P00734 2/20 0.44
PRSS2 P07478 2/20 0.44
PRSS3 P35030 2/20 0.44
TMPRSS6 Q8IU80 2/20 0.44
ST14 Q9Y5Y6 2/20 0.44
PLK1 P53350 3/20 0.42
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
ADRA2A P08913 1/20 0.39
S1PR2 O95136 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL28861449 0.98 ABL1 (0.50) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL187892 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL16439908 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL30220137 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL2720066 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL9506930 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL3395174 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL11498100 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL11476522 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2
SCHEMBL17056824 0.91 ABL1 (0.59) ABL1KCNH3EPHX1PRSS1F2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5510224-A HYDROPHOBIC SENSITIZER SEIKO INSTRUMENTS INC. (JP) 1996-04-23 US disclosed
US-5292458-A Containing polymerizable monomer and initiator SEIKO INSTRUMENTS INC. (JP) 1994-03-08 US disclosed