SCHEMBL11110153

SCHEMBL11110153

O=[C][C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCC(=O)N1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 9/20 0.36
▸ HDAC11 Q96DB2 9/20 0.36
▸ HDAC6 Q9UBN7 9/20 0.36
▸ HDAC1 Q13547 8/20 0.36
▸ HDAC2 Q92769 8/20 0.36
▸ HDAC10 Q969S8 8/20 0.36
▸ HDAC8 Q9BY41 8/20 0.36
▸ NCOR2 Q9Y618 3/20 0.35
▸ HDAC4 P56524 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ HDAC9 Q9UKV0 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ CCKBR P32239 5/20 0.34
▸ TRHR P34981 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8669058 0.80 POLB (0.39) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL31672199 0.78 TRHR (0.42) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL7788533 0.77 HDAC3 (0.42) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL7788528 0.77 HDAC3 (0.42) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL10661794 0.76 HDAC3 (0.43) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL8667278 0.74 CCKBR (0.48) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL30844021 0.74 HDAC3 (0.47) HDAC3HDAC11HDAC6HDAC1HDAC2
Glaspimod SCHEMBL609834 0.71 FOLH1 (0.48) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL7787536 0.71 HDAC3 (0.40) HDAC3HDAC11HDAC6HDAC1HDAC2
SCHEMBL7787541 0.71 HDAC3 (0.40) HDAC3HDAC11HDAC6HDAC1HDAC2

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-0097936-A2 Nonapeptide having an immunostimulating activity, process for its preparation and its use HOECHST AKTIENGESELLSCHAFT (DE) 1984-01-11 — — EP disclosed
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