SCHEMBL9999796

SCHEMBL9999796

CNCCCCCCNC(=O)c1cccc(C(C)=O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ NAAA Q02083 1/20 0.53
▸ LMNA P02545 1/20 0.51
▸ HDAC1 Q13547 2/20 0.51
▸ HDAC2 Q92769 2/20 0.51
▸ GAA P10253 3/20 0.50
▸ HDAC3 O15379 1/20 0.49
▸ HDAC4 P56524 1/20 0.49
▸ HDAC7 Q8WUI4 1/20 0.49
▸ HDAC10 Q969S8 1/20 0.49
▸ HDAC11 Q96DB2 1/20 0.49
▸ HDAC8 Q9BY41 1/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ HDAC9 Q9UKV0 1/20 0.49
▸ HDAC5 Q9UQL6 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ KMT2A Q03164 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ TP53BP1 Q12888 2/20 0.47
▸ HPGD P15428 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
SCHEMBL9999825 0.87 HDAC3 (0.58) SMN1; SMN2HDAC1HDAC2HDAC3HDAC4
SCHEMBL13328782 0.86 SMN1; SMN2 (0.79) SMN1; SMN2NAAALMNAGAAL3MBTL1
SCHEMBL5662781 0.85 SMN1; SMN2 (0.66) SMN1; SMN2LMNAHDAC1HDAC2GAA
SCHEMBL13878432 0.85 SMN1; SMN2 (0.52) SMN1; SMN2HDAC1HDAC2GAAL3MBTL1
SCHEMBL15170741 0.84 NPC1 (0.58) NAAAHDAC1HDAC2HDAC3HDAC4
SCHEMBL15237259 0.84 NPC1 (0.58) NAAAHDAC1HDAC2HDAC3HDAC4
SCHEMBL15235389 0.84 NPC1 (0.58) NAAAHDAC1HDAC2HDAC3HDAC4
SCHEMBL9925387 0.84 NPC1 (0.58) NAAAHDAC1HDAC2HDAC3HDAC4
SCHEMBL15235382 0.84 NPC1 (0.58) NAAAHDAC1HDAC2HDAC3HDAC4
SCHEMBL27563409 0.84 LMNA (0.68) SMN1; SMN2NAAALMNAHDAC1HDAC2

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-20120053293-A1 SALT RESISTANT SEMI-AROMATIC COPOLYAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (DE) 2012-03-01 — — US disclosed
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