SCHEMBL7439889

SCHEMBL7439889

Cc1c(CNC(=O)O)ccc2nc(N[C@@H](Cc3ccccc3)C(=O)N(C)Cc3ccccc3Cl)oc(=O)c12

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.43
CTRB1 P17538 3/20 0.43
TACR1 P25103 11/20 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
SCHEMBL6496064 0.92 ELANE (0.47) ELANECTRB1TACR1
SCHEMBL6505790 0.91 ELANE (0.44) ELANECTRB1TACR1
SCHEMBL6500724 0.91 ELANE (0.43) ELANECTRB1TACR1
SCHEMBL6805565 0.90 ELANE (0.43) ELANECTRB1TACR1
SCHEMBL6506622 0.87 ELANE (0.46) ELANECTRB1TACR1
SCHEMBL7840392 0.87 LMNA (0.46) ELANECTRB1TACR1
SCHEMBL6498129 0.86 ELANE (0.44) ELANECTRB1TACR1
SCHEMBL6497451 0.84 ELANE (0.42) ELANECTRB1TACR1
SCHEMBL7841675 0.84 ELANE (0.48) ELANECTRB1
SCHEMBL7444283 0.83 ELANE (0.51) ELANECTRB1TACR1

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-0828721-B1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS SEARLE & CO (US) 2001-11-14 EP disclosed
EP-1122245-A2 2-Amino-benzoxazinones for the treatment of viral infections G.D. Searle & Co. (US) 2001-08-08 EP disclosed
WO-1996037485-A1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS G.D. SEARLE & CO. (US) 1996-11-28 WO disclosed