SCHEMBL8664965

SCHEMBL8664965

COc1ccccc1S(=O)(=O)N(CC(O)C(O)C(O)CO)c1cc(C)cc(OCCNc2ccnnc2)c1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 14/20 0.62
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.32
PSMB5 P28074 1/20 0.32
ALPL P05186 1/20 0.32

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
SCHEMBL8652523 0.93 F2 (0.54) F2HPGD
SCHEMBL8649759 0.93 F2 (0.54) F2HPGDPSMB5
SCHEMBL7374410 0.92 F2 (0.53) F2HPGDPSMB5
SCHEMBL7409794 0.92 F2 (0.63) F2HPGD
SCHEMBL8648601 0.89 F2 (0.59) F2HPGD
SCHEMBL7371001 0.87 F2 (0.69) F2HPGDTSHRALPL
SCHEMBL8649210 0.86 F2 (0.60) F2HPGD
SCHEMBL7374256 0.86 F2 (0.59) F2HPGD
SCHEMBL8650605 0.85 F2 (0.59) F2HPGDTSHR
SCHEMBL7373800 0.85 F2 (0.54) F2HPGDPSMB5ALPL

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-5795892-A ANTICOAGULANTS BOEHRINGER MANNEIM GMBH (DE) 1998-08-18 US disclosed