SCHEMBL14964288

SCHEMBL14964288

N=C(c1nonc1Cn1nnnc1-c1ccccn1)N(O)c1ccc(F)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.39
P2RX7 Q99572 2/20 0.33
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
OPRK1 P41145 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
SCHEMBL14964226 0.85 STAT5B (0.41) P2RX7HTT
SCHEMBL14964185 0.85 POLB (0.32)
SCHEMBL14462399 0.84 HDAC6 (0.39) HDAC6P2RX7LMNAMAPT
SCHEMBL15093281 0.83 IDO1 (0.33)
SCHEMBL14964298 0.82 STAT5B (0.41)
SCHEMBL4983469 0.80 HDAC6 (0.39) HDAC6P2RX7LMNAMAPT
SCHEMBL4983463 0.80 HDAC6 (0.39) HDAC6P2RX7LMNAMAPT
SCHEMBL14964276 0.79
SCHEMBL14964240 0.78
SCHEMBL4983481 0.78 IDO1 (0.50)

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