SCHEMBL14097573

SCHEMBL14097573

CCNC(=O)Nc1nc2cc(-c3cnc(N)nc3)c(F)cc2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 13/20 0.55

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
SCHEMBL14097562 0.87 ABL1 (0.59) ABL1
SCHEMBL14097438 0.82 ABL1 (0.74) ABL1
SCHEMBL14097429 0.82 ABL1 (0.59) ABL1
SCHEMBL14097531 0.77 ABL1 (0.60) ABL1
SCHEMBL14097583 0.77 ABL1 (0.66) ABL1
SCHEMBL988131 0.75 ABL1 (0.45) ABL1
SCHEMBL8997492 0.74 ABL1 (0.42) ABL1
SCHEMBL8999513 0.74 ABL1 (0.45) ABL1
SCHEMBL986577 0.74 ABL1 (0.46) ABL1
SCHEMBL11953719 0.74 ABL1 (0.46) ABL1

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 5 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
EP-1341769-B1 BACTERIAL GYRASE INHIBITORS AND USES THEREOF VERTEX PHARMA (US) 2007-10-17 — — EP disclosed
Send feedback