SCHEMBL14097653

SCHEMBL14097653

CCNC(=O)Nc1nc2nc(-n3cnc(C(=O)OC)c3)ccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ ABL1 P00519 9/20 0.40
▸ MAPT P10636 1/20 0.39

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
SCHEMBL14097654 0.90 KDM4E (0.44) ABL1
SCHEMBL14097501 0.87 ABL1 (0.38) MEN1KMT2AABL1MAPT
SCHEMBL14207569 0.84 CYP2C19 (0.47) ABL1
SCHEMBL14097616 0.82 ABL1 (0.48) ABL1
SCHEMBL3851404 0.80 ABL1 (0.53) ABL1
SCHEMBL14097615 0.71 ABL1 (0.49) ABL1
SCHEMBL14097720 0.69 ABL1 (0.57) ABL1
SCHEMBL5081749 0.69 ABL1 (0.57) ABL1
SCHEMBL14097468 0.69 ABL1 (0.40) ABL1
SCHEMBL23071954 0.69 MEN1 (0.65) MEN1KMT2AMAPT

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-7414046-B2 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-08-19 — — US disclosed
US-7414046-B2 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-08-19 — — US disclosed
US-RE40245-E1 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-04-15 — — US disclosed
US-RE40245-E1 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-04-15 — — US disclosed
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