SCHEMBL4738992

SCHEMBL4738992

NC(c1ccon1)c1cc(-c2cccc(F)c2-n2cnc(CO)c2)no1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.31
NCOR1 O75376 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31

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
SCHEMBL4738996 0.78 IGF1R (0.30)
SCHEMBL4680634 0.64 PSEN1 (0.33)
SCHEMBL4679671 0.64 MAPT (0.43)
SCHEMBL4679789 0.61 BLM (0.35)
SCHEMBL4742817 0.61 DPP4 (0.32) HDAC3NCOR1HDAC1HDAC2HDAC8
SCHEMBL20163055 0.60 NOTUM (0.54)
SCHEMBL30037283 0.60 NOTUM (0.54)
SCHEMBL11046359 0.59 CPB1 (0.39)
SCHEMBL31434554 0.58 NOTUM (0.56)
SCHEMBL4680902 0.57 MAPKAPK2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1437349-B9 SUBSTITUTED ISOXAZOLES AND THE USE THEREOF AS ANTIBIOTICS S A L V A T LAB SA (ES) 2008-09-10 EP disclosed
EP-1437349-B1 SUBSTITUTED ISOXAZOLES AND THE USE THEREOF AS ANTIBIOTICS S A L V A T LAB SA (ES) 2007-08-15 EP disclosed