SCHEMBL8183370

SCHEMBL8183370

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)N4CCN(C(=O)c5ccc(C(=N)N)cn5)CC4)c3Cl)c2n1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 4/20 0.70
RORC P51449 16/20 0.64

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
SCHEMBL8183368 1.00 BDKRB2 (0.70) BDKRB2RORC
SCHEMBL6442652 0.94 BDKRB2 (0.75) BDKRB2RORC
SCHEMBL1772938 0.94 BDKRB2 (0.75) BDKRB2RORC
Hydrochloric Acid SCHEMBL8182811 0.93 BDKRB2 (0.74) BDKRB2RORC
Hydrochloric Acid SCHEMBL8182794 0.93 BDKRB2 (0.74) BDKRB2RORC
SCHEMBL8173711 0.93 RORC (0.63) BDKRB2RORC
SCHEMBL8173713 0.93 RORC (0.63) BDKRB2RORC
SCHEMBL8443103 0.93 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL8443100 0.93 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL7805306 0.92 BDKRB2 (0.70) BDKRB2RORC

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-6071917-A ANALGESICS; ANTIINFLAMMATORY AGENTS; ESPECIALLY FOR THE TREATMENT OF ASTHMA, CEREBRAL TRAUMATIC SHOCK AND ALLERGIC RHINITIS; COMPETITIVE BINDING AT RECEPTORS FOURNIER INDUSTRIE ET SANTE (FR) 2000-06-06 US disclosed