SCHEMBL10143782

SCHEMBL10143782

Cc1cc(=O)[nH]c2cc(NC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)NCCc3c[nH]c4ccccc34)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MAPT P10636 3/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ GOT1 P17174 1/20 0.44
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ HDAC9 Q9UKV0 1/20 0.44
▸ HDAC5 Q9UQL6 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CCKBR P32239 2/20 0.43

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
SCHEMBL10144456 0.85 CCKBR (0.41) MAPTSMN1; SMN2CA1CA2HDAC3
SCHEMBL10143368 0.82 HDAC3 (0.44) MEN1KMT2AMAPTSMN1; SMN2CA1
SCHEMBL10144432 0.78 CA1 (0.45) KMT2AMAPTCA1CA2HDAC3
SCHEMBL10144455 0.78 CCKBR (0.40) CA1CA2HDAC3HDAC4HDAC1
SCHEMBL10144322 0.77 CA1 (0.45) MEN1KMT2AMAPTCA1CA2
SCHEMBL10143785 0.77 CA1 (0.45) MEN1KMT2AMAPTCA1CA2
SCHEMBL10143484 0.77 CA1 (0.45) MAPTCA1CA2HDAC3HDAC4
SCHEMBL10144442 0.76 CA1 (0.45) KMT2AMAPTCA1CA2HDAC3
SCHEMBL10143496 0.75 CA1 (0.42) KMT2AMAPTCA1CA2HDAC3
SCHEMBL7550956 0.75 MEN1 (0.50) MEN1KMT2AMAPTHDAC3HDAC4

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-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 — — WO disclosed
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