SCHEMBL8728148

SCHEMBL8728148

CCCCCCC(CO)NS(=O)(=O)CCCc1ccccc1.O=P(=O)C(O)COCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.36
CTRC Q99895 1/20 0.35
CASP1 P29466 1/20 0.35
ASAH2 Q9NR71 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
TAOK1 Q7L7X3 1/20 0.34
TAOK3 Q9H2K8 1/20 0.34
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33

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
SCHEMBL8729245 0.97 ASAH2 (0.36) ARCTRCASAH2
SCHEMBL8733007 0.97 ASAH2 (0.36) ARCTRCASAH2
SCHEMBL8733000 0.97 ASAH2 (0.36) ARCTRCASAH2
SCHEMBL8733057 0.95 ASAH2 (0.38) ARCTRCASAH2
SCHEMBL8732304 0.95 ASAH2 (0.38) ARCTRCASAH2
SCHEMBL8727549 0.95 ASAH2 (0.38) ARCTRCASAH2
SCHEMBL8730272 0.95 ASAH2 (0.38) ARCTRCASAH2
SCHEMBL8731343 0.95 ASAH2 (0.38) ARCTRCASAH2
SCHEMBL8729375 0.95 ASAH2 (0.38) ARCTRCASAH2
SCHEMBL8733270 0.95 ASAH2 (0.38) ARCTRCASAH2

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
EP-0701561-B1 DESOXYAZAPHOSPHOLIPID DERIVATIVES HAVING INHIBITING ACTIVITY ON PHOSPHOLIPASE A2 MENARINI LAB (ES) 1998-08-19 EP claimed
EP-0701561-B1 DESOXYAZAPHOSPHOLIPID DERIVATIVES HAVING INHIBITING ACTIVITY ON PHOSPHOLIPASE A2 MENARINI LAB (ES) 1998-08-19 EP disclosed