SCHEMBL4363497

SCHEMBL4363497

COc1cccc(C(=O)Nc2nonc2/C(=N/O)Nc2ccc(F)c(Br)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 10/20 0.61
SMN1; SMN2 Q16637 4/20 0.45
RAB9A P51151 4/20 0.45
NPC1 O15118 3/20 0.45
POLB P06746 1/20 0.45
HTT P42858 1/20 0.45
TP53 P04637 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 1/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL2515048 1.00 IDO1 (0.61) IDO1SMN1; SMN2RAB9ANPC1POLB
SCHEMBL2515050 1.00 IDO1 (0.61) IDO1SMN1; SMN2RAB9ANPC1POLB
SCHEMBL2518175 0.90 IDO1 (0.49) IDO1MEN1KMT2A
SCHEMBL2518177 0.90 IDO1 (0.49) IDO1MEN1KMT2A
SCHEMBL12230824 0.90 IDO1 (0.49) IDO1MEN1KMT2A
SCHEMBL2516645 0.90 IDO1 (0.61) IDO1
SCHEMBL2516648 0.90 IDO1 (0.61) IDO1
SCHEMBL12054238 0.88 IDO1 (0.55) IDO1SMN1; SMN2RAB9ANPC1POLB
SCHEMBL30209401 0.88 IDO1 (0.77) IDO1RAB9AHTTTP53ALDH1A1
SCHEMBL16366474 0.88 IDO1 (0.48) IDO1

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-1879573-A4 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORP (US) 2009-07-08 EP claimed
EP-1879573-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME Incyte Corporation (US) 2008-01-23 EP claimed
WO-2006122150-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2006-11-16 WO claimed