SCHEMBL14964298

SCHEMBL14964298

N=C(c1nonc1Cn1nnnc1Cc1ccccc1)N(O)c1ccc(F)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
STAT5B P51692 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 4/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
IDO1 P14902 1/20 0.32
CNR2 P34972 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL15093281 0.85 IDO1 (0.33) SMN1; SMN2IDO1
SCHEMBL14964185 0.85 POLB (0.32) SMN1; SMN2ALDH1A1TSHR
SCHEMBL14964240 0.85
SCHEMBL14462760 0.84 SMN1; SMN2 (0.45) STAT5BSMN1; SMN2MEN1KMT2A
SCHEMBL14964181 0.84
SCHEMBL14964365 0.83 HDAC6 (0.38) SMN1; SMN2IDO1CNR2
SCHEMBL14964226 0.82 STAT5B (0.41) STAT5BALDH1A1
SCHEMBL14964288 0.82 HDAC6 (0.39)
SCHEMBL14964276 0.80
SCHEMBL4981010 0.80 SMN1; SMN2 (0.44) STAT5BSMN1; SMN2MEN1KMT2AIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450351-B2 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION (US) 2013-05-28 US claimed