SCHEMBL4494610

SCHEMBL4494610

Cc1cccc(-c2ccc3c(NC(=O)NCCCn4ccnc4)n[nH]c3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.52
LMNA P02545 4/20 0.52
ALDH1A1 P00352 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
CYP1A2 P05177 3/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
HSD17B10 Q99714 2/20 0.47
QPCT Q16769 1/20 0.47
ALOX15 P16050 1/20 0.47
GAA P10253 1/20 0.46
RAD52 P43351 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GSK3B P49841 4/20 0.45
MEN1 O00255 2/20 0.45

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
SCHEMBL4481640 0.92 KDM4E (0.52) KDM4ELMNAALDH1A1L3MBTL1CYP1A2
SCHEMBL4487221 0.89 HDAC1 (0.56) KDM4ELMNAALDH1A1L3MBTL1QPCT
SCHEMBL4503182 0.89 AAK1 (0.55) KDM4ELMNAALDH1A1L3MBTL1CYP1A2
SCHEMBL4502734 0.86 ALDH1A1 (0.55) KDM4EALDH1A1QPCTGAAMAPT
SCHEMBL4488444 0.84 GSK3B (0.55) KDM4ELMNAALDH1A1L3MBTL1CYP1A2
SCHEMBL4502574 0.83 GSK3B (0.57) CYP1A2GSK3B
SCHEMBL4498152 0.83 GSK3B (0.52) CYP1A2GSK3B
SCHEMBL4502522 0.83 HDAC1 (0.56) KDM4EALDH1A1L3MBTL1HSD17B10QPCT
SCHEMBL4505096 0.82 GSK3B (0.51) CYP1A2GSK3B
SCHEMBL4480187 0.81 GSK3B (0.59) CYP1A2GSK3B

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
US-7632854-B2 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2009-12-15 US claimed