SCHEMBL7165657

SCHEMBL7165657

CC(NC(=O)c1ccc[nH]c1=O)c1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
MAPK1 P28482 1/20 0.47
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 3/20 0.45
HTT P42858 2/20 0.44
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 3/20 0.41
MEN1 O00255 4/20 0.41
PDE2A O00408 3/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL16240114 0.83 KMT2A (0.53) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL27637680 0.82 KMT2A (0.52) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL6553866 0.79 LMNA (0.60) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL526159 0.79 KMT2A (0.59) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL27618514 0.77 KMT2A (0.51) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL3456624 0.75 KMT2A (0.56) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL7165659 0.75 KMT2A (0.48) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL6030604 0.74 KMT2A (0.53) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL6030503 0.74 KMT2A (0.53) KMT2AMAPK1LMNASMN1; SMN2GAA
SCHEMBL6029698 0.72 KMT2A (0.52) KMT2AMAPK1LMNASMN1; SMN2GAA

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
EP-1322614-A2 PYRIDINYL AMIDES AND IMIDES FOR USE AS FUNGICIDES E. I. du Pont de Nemours and Company (US) 2003-07-02 EP disclosed
WO-2002022583-A2 PYRIDINYL AMIDES AND IMIDES FOR USE AS FUNGICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-03-21 WO disclosed