SCHEMBL892669

SCHEMBL892669

CCS(=O)(=O)S(=O)(=O)CC

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
CYP3A4 P08684 1/20 0.36
CA1 P00915 7/20 0.33
CA2 P00918 4/20 0.33
CA12 O43570 2/20 0.30
CA14 Q9ULX7 2/20 0.30
CA7 P43166 1/20 0.30

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
SCHEMBL4102124 0.80 KDM4E (0.31) KDM4ECYP3A4CA1CA2
SCHEMBL4373553 0.80 FAAH (0.33) CA1CA2
SCHEMBL10946746 0.80 FAAH (0.39) CA2
SCHEMBL10945368 0.80 FAAH (0.33) CA2
SCHEMBL10943521 0.78 FAAH (0.43) CA2
SCHEMBL10946005 0.78 FAAH (0.43) CA2
SCHEMBL2894492 0.77
SCHEMBL10765103 0.75 CA2 (0.30) CA2
SCHEMBL28330357 0.74
SCHEMBL892430 0.67 FAAH (0.36) CA1CA2CA12CA14CA7

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 3 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
US-4873321-A COLORFASTNESS, REPRODUCIBILITY; FOR COTTON, CELLULOSE, WOOL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-10-10 US disclosed