SCHEMBL7951571

SCHEMBL7951571

COC(=O)C1CCCN1S(=O)(=O)c1ccc(Cl)c(COc2cccc3ccc(C)nc23)c1Cl

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RORC P51449 12/20 0.64
BDKRB2 P30411 8/20 0.58
BDKRB1 P46663 1/20 0.56

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
SCHEMBL7951569 1.00 RORC (0.64) RORCBDKRB2BDKRB1
SCHEMBL7814536 0.92 RORC (0.74) RORCBDKRB2
SCHEMBL7814538 0.92 RORC (0.74) RORCBDKRB2
SCHEMBL7952877 0.90 BDKRB2 (0.61) RORCBDKRB2BDKRB1
SCHEMBL7815597 0.90 RORC (0.65) RORCBDKRB2BDKRB1
Hydrochloric Acid SCHEMBL7952875 0.90 BDKRB2 (0.60) RORCBDKRB2BDKRB1
SCHEMBL7805674 0.89 BDKRB2 (0.64) RORCBDKRB2BDKRB1
SCHEMBL7805546 0.89 RORC (0.65) RORCBDKRB2BDKRB1
SCHEMBL7952802 0.88 RORC (0.72) RORCBDKRB2
SCHEMBL7805147 0.88 BDKRB2 (0.64) RORCBDKRB2BDKRB1

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-6211181-B1 ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIALLERGENS, AND ANTIASTHMATICS FOURNIER INDUSTRIE ET SANTE (FR) 2001-04-03 US disclosed
US-6080758-A ANALGESICS, ANTIINFLAMMATORY AGENTS; ASTHMA; ALLERGIC RHINITIS FOURNIER INDUSTRIE ET SANTE (FR) 2000-06-27 US disclosed