SCHEMBL15534348

SCHEMBL15534348

Oc1ccc(-c2ccnc(Nc3ccc(C(F)(F)F)cn3)n2)cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
GAA P10253 4/20 0.46
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CLK1 P49759 3/20 0.43
CLK2 P49760 2/20 0.43
DYRK1A Q13627 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
DYRK1B Q9Y463 2/20 0.43
POLB P06746 4/20 0.42
KDM4E B2RXH2 2/20 0.42
CTSC P53634 1/20 0.42
PKM P14618 1/20 0.42
NFKB1 P19838 1/20 0.42
MPI P34949 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 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
SCHEMBL15534057 0.86 CLK1 (0.47) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL15534289 0.84 SYK (0.59) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL15533647 0.82 PIK3CG (0.45) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL15533684 0.81 DYRK1A (0.47) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL15533706 0.81 MEN1 (0.46) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL15534386 0.80 DYRK1A (0.68) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL15534293 0.80 SYK (0.49) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL15533886 0.79 CLK1 (0.67) CLK1CLK2DYRK1ACLK4DYRK1B
SCHEMBL15534555 0.79 ABL1 (0.49) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL15533252 0.77 DKK1 (0.47) CLK1CLK2DYRK1ACLK4DYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013175415-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF Piramal Enterprises Limited (IN) 2013-11-28 WO claimed
WO-2013175415-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF Piramal Enterprises Limited (IN) 2013-11-28 WO disclosed