SCHEMBL20344103

SCHEMBL20344103

NC1=CC(=O)/C(=C/c2c[nH]c3ncccc23)O1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HASPIN Q8TF76 4/20 0.54
KMT2A Q03164 1/20 0.52
CDC7 O00311 10/20 0.50
CHEK1 O14757 1/20 0.48
CCNT1 O60563 2/20 0.46
CDK9 P50750 2/20 0.46
PIM1 P11309 2/20 0.43
PIM2 Q9P1W9 2/20 0.43
GSK3B P49841 1/20 0.43
PIM3 Q86V86 1/20 0.42

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
SCHEMBL15411899 0.81 HASPIN (0.50) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL12969522 0.81 CDC7 (0.51) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL15411898 0.81 HASPIN (0.50) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL15410717 0.81 CDC7 (0.51) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL15410718 0.81 CDC7 (0.51) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL12968797 0.81 HASPIN (0.50) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL15410420 0.80 CDC7 (0.53) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL12968685 0.80 CDC7 (0.53) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL15410419 0.80 CDC7 (0.53) HASPINKMT2ACDC7CHEK1CCNT1
SCHEMBL15411867 0.79 HASPIN (0.48) HASPINKMT2ACDC7CHEK1CCNT1

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
EP-2692728-B1 NOVEL FURANONE DERIVATIVE CARNA BIOSCIENCES INC (JP) 2018-07-04 EP disclosed