SCHEMBL6992565

SCHEMBL6992565

O=C(O)Cc1nc2ccccc2c(=O)o1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 17/20 0.66
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
C1R P00736 1/20 0.56
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
PDE10A Q9Y233 1/20 0.49

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
SCHEMBL5370167 0.87 ELANE (0.68) ELANEMEN1KMT2AC1R
SCHEMBL6342514 0.84 ELANE (0.64) ELANEMEN1KMT2AC1R
SCHEMBL6136297 0.82 ELANE (0.83) ELANEMEN1KMT2AC1RPDE10A
SCHEMBL692733 0.82 ELANE (0.81) ELANEMEN1KMT2AC1RPDE10A
SCHEMBL29405904 0.82 ELANE (0.81) ELANEMEN1KMT2AC1RPDE10A
SCHEMBL10340248 0.81 ELANE (0.59) ELANEMEN1KMT2AC1RPDE10A
SCHEMBL14068580 0.81 ELANE (0.64) ELANEMEN1KMT2A
SCHEMBL692829 0.79 ELANE (0.76) ELANEMEN1KMT2AC1RPDE10A
SCHEMBL3112570 0.79 NPC1 (0.61) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL31614347 0.79 NPC1 (0.61) MEN1KMT2ANR4A1NR4A2NR4A3

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
EP-0980374-B1 PHOSPHODIESTERASE 4-INHIBITING DIAZEPINOINDOLONES PFIZER HOLDING FRANCE (FR) 2003-02-12 EP disclosed
US-6239130-B1 ASTHMA, ATOPIC DERMATITIS, RHEUMATOID ARTHRITIS, INFLAMMATORY BOWEL DISORDERS, PULMONARY HYPERTENSION, LIVER INJURY, BONE LOSS, SEPTIC SHOCK, OR MULTIPLE SCLEROSIS, WARNER-LAMBERT COMPANY 2001-05-29 US disclosed
EP-0980374-A1 PHOSPHODIESTERASE 4-INHIBITING DIAZEPINOINDOLONES PARKE-DAVIS (FR) 2000-02-23 EP disclosed
WO-1998049169-A1 PHOSPHODIESTERASE 4-INHIBITING DIAZEPINOINDOLONES PARKE-DAVIS (FR) 1998-11-05 WO disclosed