SCHEMBL4076192

SCHEMBL4076192

NNC(=O)CCCc1[nH]c2ccc(C(=O)NN)cc2c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.45
ALDH1A1 P00352 7/20 0.45
MAPT P10636 6/20 0.45
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 2/20 0.41
GAA P10253 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.38
HPGD P15428 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PKM P14618 1/20 0.37
GFER P55789 1/20 0.37
HTT P42858 1/20 0.37
HDAC3 O15379 3/20 0.36
HDAC1 Q13547 3/20 0.36
SIRT1 Q96EB6 1/20 0.35
HDAC4 P56524 2/20 0.35

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
SCHEMBL4075137 0.81 MEN1 (0.43) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL27968518 0.73 KDM4E (0.63) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL4079956 0.73 MTNR1A (0.42) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL13697479 0.67 KDM4E (0.69) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL27370614 0.67 MAPT (0.51) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL1061505 0.66 KDM4E (0.67) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL27825029 0.66 ALDH1A1 (0.59) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL9240048 0.65 ALDH1A1 (0.58) KDM4EALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL22074021 0.63 ALOX5 (0.46) MAPTSMN1; SMN2GAAL3MBTL1MEN1
SCHEMBL6243452 0.62 MAPT (1.00) KDM4EALDH1A1MAPTLMNASMN1; SMN2

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
WO-2009155362-A1 SMALL MOLECULE HEMATOPOIETIC GROWTH FACTOR MIMETIC COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2009-12-23 WO disclosed