SCHEMBL7333378

SCHEMBL7333378

CN(C(=O)c1ccccc1)c1nc2cc(NC(=N)N)ccc2c(=O)o1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.50
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAOB P27338 1/20 0.39
MAPK10 P53779 1/20 0.39
C1R P00736 5/20 0.38
PRSS1 P07477 2/20 0.38

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
SCHEMBL7337855 0.93 ELANE (0.48) ELANEKDM4EALDH1A1MAPTMEN1
SCHEMBL7333376 0.90 ELANE (0.54) ELANEKDM4EALDH1A1MEN1KMT2A
SCHEMBL7338273 0.89 ELANE (0.58) ELANEKDM4EALDH1A1C1RPRSS1
SCHEMBL7336411 0.87 ELANE (0.43) ELANEKDM4EALDH1A1LMNAMAPT
SCHEMBL7331994 0.86 ELANE (0.53) ELANEKDM4EALDH1A1LMNAMAPT
SCHEMBL7335520 0.85 ELANE (0.41) ELANEKDM4EALDH1A1LMNAMAPT
SCHEMBL7333539 0.81 ELANE (0.74) ELANELMNASMN1; SMN2C1RPRSS1
SCHEMBL7330994 0.81 ELANE (0.51) ELANEKDM4EALDH1A1LMNAMAPT
SCHEMBL7329441 0.80 ELANE (0.63) ELANEC1RPRSS1
SCHEMBL7331492 0.80 NPC1 (0.51) ALDH1A1LMNAMAPTMEN1KMT2A

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 4 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 claimed
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 claimed
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