SCHEMBL903036

SCHEMBL903036

Cc1onc(C2N=CC=CC2C)c1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
RECQL P46063 1/20 0.34
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL903086 0.72 LMNA (0.34) LMNARECQLMEN1GAAKMT2A
SCHEMBL12021938 0.69 SMN1; SMN2 (0.34) LMNARECQLMEN1GAAKMT2A
SCHEMBL21590983 0.69 LMNA (0.32) LMNARECQL
SCHEMBL23062876 0.67 BRD4 (0.40) LMNARECQLMEN1GAAKMT2A
SCHEMBL903069 0.65 GAA (0.33) LMNARECQLMEN1GAAKMT2A
SCHEMBL6889091 0.63 RECQL (0.43) LMNARECQLMEN1GAAKMT2A
SCHEMBL470293 0.62 KDM4E (0.31) MEN1KMT2AHTT
SCHEMBL223413 0.62 GAA (0.49) LMNAMEN1GAAKMT2A
SCHEMBL2807054 0.60 LMNA (0.54) LMNARECQLMEN1GAAKMT2A
SCHEMBL4795046 0.60 GAA (0.41) LMNARECQLMEN1GAAKMT2A

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
WO-2012044531-A1 NOVEL PIPERAZINE ANALOGS WITH SUBSTITUTED HETEROARYL GROUPS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-05 WO disclosed