SCHEMBL5268751

SCHEMBL5268751

O=C(Cc1c[nH]c2ccccc12)Nc1c[nH]nc1C(=O)NCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 3/20 0.50
KMT2A Q03164 2/20 0.50
SLC6A2 P23975 1/20 0.50
FNTA P49354 1/20 0.50
FNTB P49356 1/20 0.50
MEN1 O00255 1/20 0.50
STAT3 P40763 1/20 0.50
RAB9A P51151 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GLA P06280 1/20 0.49
HTT P42858 2/20 0.47
CYP1A2 P05177 1/20 0.47
POLB P06746 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL5272692 0.92 SIRT1 (0.54) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL5268260 0.88 MAPT (0.51) LMNAMAPTKMT2AMEN1STAT3
SCHEMBL2930131 0.88 MAPT (0.55) LMNASMN1; SMN2MAPTKMT2ASLC6A2
SCHEMBL5266468 0.86 POLB (0.58) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL5272614 0.85 CYP1A2 (0.53) LMNAMAPTKMT2AMEN1STAT3
SCHEMBL954893 0.82 ALDH1A1 (0.50) LMNAMAPTKMT2AMEN1STAT3
SCHEMBL5270583 0.82 RAB9A (0.51) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL5268895 0.81 LMNA (0.56) LMNASMN1; SMN2KMT2ASLC6A2MEN1
SCHEMBL5268095 0.81 MAPT (0.53) LMNAMAPTKMT2AMEN1RAB9A
SCHEMBL5267185 0.80 POLB (0.48) LMNASMN1; SMN2MAPTKMT2AMEN1

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-1847531-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-10-24 EP disclosed