SCHEMBL9508472

SCHEMBL9508472

Cc1nc2cc([N+](=O)[O-])ccc2c(=O)o1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.59
F3 P13726 1/20 0.59
C1R P00736 3/20 0.57
ELANE P08246 4/20 0.53
ALDH1A1 P00352 4/20 0.48
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
MAPT P10636 6/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
RAB9A P51151 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 3/20 0.46
GAA P10253 2/20 0.46
NPC1 O15118 2/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
MPI P34949 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL2256405 0.88 ELANE (0.62) F7F3ELANEALDH1A1MEN1
SCHEMBL6567235 0.81 MEN1 (0.72) F7F3C1RELANEALDH1A1
SCHEMBL2060733 0.80 ALDH1A1 (0.61) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL31742430 0.79 C1R (0.74) F7F3C1RELANEMEN1
SCHEMBL10489816 0.78 ELANE (0.64) F7F3C1RELANEMEN1
SCHEMBL11812017 0.77 MAPT (0.76) F7F3C1RELANEALDH1A1
SCHEMBL28961941 0.77 ELANE (0.74) C1RELANEALDH1A1MEN1KMT2A
SCHEMBL7428429 0.77 PARP1 (0.54) F7F3C1RALDH1A1MAPT
SCHEMBL2062399 0.76 MAPT (0.60) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL31742426 0.76 RAB9A (0.75) F7F3C1RELANEALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0317645-B1 4H-3,1-BENZOXAZIN-4-ONE COMPOUNDS AND SERINE PROTEASE-INHIBITING MEDICINAL COMPOSITION CONTAINING SAME TEIJIN LIMITED (JP) 1993-09-15 EP disclosed
US-4980287-A ANTIINFLAMMATORY AGENTS; INHIBITOR OF DEGENERATION AND DESTRUCTION OF TISSUES TEIJIN LIMITED (JP) 1990-12-25 US disclosed
EP-0317645-A1 4H-3,1-BENZOXAZIN-4-ONE COMPOUNDS AND SERINE PROTEASE-INHIBITING MEDICINAL COMPOSITION CONTAINING SAME TEIJIN LIMITED (JP) 1989-05-31 EP disclosed