SCHEMBL7337985

SCHEMBL7337985

Cc1cccc2nc(N(C)C(=O)c3ccccc3I)oc(=O)c12

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
C1R P00736 2/20 0.54
ELANE P08246 17/20 0.53
CTRB1 P17538 3/20 0.42

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
SCHEMBL7332864 0.88 C1R (0.53) C1RELANE
SCHEMBL7333602 0.83 ELANE (0.66) C1RELANE
SCHEMBL10362993 0.80 ELANE (0.64) C1RELANECTRB1
SCHEMBL7331779 0.79 C1R (0.55) C1RELANE
SCHEMBL7332215 0.79 MAPT (0.58) C1RELANE
SCHEMBL7364114 0.77 ELANE (0.67) C1RELANE
SCHEMBL7332212 0.76 C1R (0.53) C1RELANE
SCHEMBL7333524 0.76 C1R (0.54) C1RELANE
SCHEMBL7332663 0.76 C1R (0.51) C1RELANE
SCHEMBL7364248 0.74 ELANE (0.47) C1RELANE

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-5652237-A 2-substituted-4H-3, 1-benzoxazin-4-ones and benzthiazin-4-ones as inhibitors of complement C1r protease for the treatment of inflammatory processes WARNER-LAMBERT COMPANY (US) 1997-07-29 US disclosed
WO-1996007648-A1 2-SUBSTITUTED-4H-3,1-BENZOXAZIN-4-ONES AND BENZTHIAZIN-4-ONES AS INHIBITORS OF COMPLEMENT Clr PROTEASE FOR THE TREATMENT OF INFLAMMATORY PROCESSES WARNER-LAMBERT COMPANY (US) 1996-03-14 WO disclosed