SCHEMBL7367511

SCHEMBL7367511

CCCCc1ccc(C(=O)N(C)c2nc3ccccc3c(=O)o2)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 11/20 0.58
DHODH Q02127 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
C1R P00736 3/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PRSS1 P07477 1/20 0.45
MAOB P27338 1/20 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
SCHEMBL7333539 0.85 ELANE (0.74) ELANEC1RLMNASMN1; SMN2PRSS1
SCHEMBL7363986 0.82 ELANE (0.66) ELANEC1RPRSS1
SCHEMBL7329441 0.80 ELANE (0.63) ELANEC1RPRSS1
SCHEMBL7339172 0.80 ELANE (0.63) ELANEC1RALDH1A1LMNASMN1; SMN2
SCHEMBL7335445 0.79 C1R (0.62) ELANEC1RALDH1A1PRSS1
SCHEMBL8898601 0.78 ELANE (0.64) ELANEC1RALDH1A1PRSS1MAOB
SCHEMBL8898664 0.77 ELANE (0.63) ELANEC1RALDH1A1PRSS1MAOB
SCHEMBL8899961 0.77 ELANE (0.63) ELANEC1RALDH1A1PRSS1MAOB
SCHEMBL8899228 0.77 ELANE (0.63) ELANEC1RALDH1A1PRSS1MAOB
SCHEMBL10362975 0.77 ELANE (0.63) ELANEC1RALDH1A1PRSS1MAOB

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