SCHEMBL892430

SCHEMBL892430

CCCS(=O)(=O)S(=O)(=O)CCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.36
CA1 P00915 5/20 0.35
NPC1 O15118 1/20 0.35
S1PR2 O95136 1/20 0.35
S1PR4 O95977 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
XBP1 P17861 1/20 0.35
S1PR1 P21453 1/20 0.35
MAPK1 P28482 1/20 0.35
AGTR1 P30556 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL4373553 0.93 FAAH (0.33) FAAHCA1NPC1S1PR2S1PR4
SCHEMBL7838446 0.82 FAAH (0.32) FAAHCA1NPC1S1PR2S1PR4
SCHEMBL152599 0.75
SCHEMBL9861596 0.75 CA2 (0.34) FAAHCA2
SCHEMBL6345042 0.75 CA2 (0.31) CA2
SCHEMBL10942331 0.74 FAAH (0.57) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL10944088 0.72 FAAH (0.62) FAAHTSHRCA2
SCHEMBL15234409 0.72 FAAH (0.62) FAAHTSHRCA2
SCHEMBL10946851 0.72 FAAH (0.55) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL10946389 0.72 FAAH (0.62) FAAHTSHRCA2

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-8657433-B2 Porphyrazine coloring matter, ink composition, recording method, and colored object NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2014-02-25 US disclosed
US-20120081457-A1 PORPHYRAZINE COLORING MATTER, INK COMPOSITION, RECORDING METHOD, AND COLORED OBJECT NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-04-05 US disclosed