SCHEMBL9071934

SCHEMBL9071934

CCCCCCC(=O)Nc1ncc(SCC(=O)O)s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK10 P53779 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ HDAC3 O15379 3/20 0.53
▸ HDAC4 P56524 3/20 0.53
▸ HDAC1 Q13547 3/20 0.53
▸ HDAC7 Q8WUI4 3/20 0.53
▸ HDAC2 Q92769 3/20 0.53
▸ HDAC10 Q969S8 3/20 0.53
▸ HDAC11 Q96DB2 3/20 0.53
▸ HDAC8 Q9BY41 3/20 0.53
▸ HDAC6 Q9UBN7 3/20 0.53
▸ HDAC9 Q9UKV0 3/20 0.53
▸ HDAC5 Q9UQL6 3/20 0.53
▸ CCND3 P30281 3/20 0.53
▸ CDK6 Q00534 3/20 0.53
▸ LMNA P02545 1/20 0.50
▸ CCNE1 P24864 8/20 0.49
▸ CDK2 P24941 8/20 0.49
▸ CCNE2 O96020 6/20 0.49
▸ CCNB2 O95067 3/20 0.49

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
SCHEMBL2667689 0.91 CCNE1 (0.46) MAPK10SMN1; SMN2HDAC3HDAC4HDAC1
SCHEMBL2668480 0.86 HDAC3 (0.49) MAPK10SMN1; SMN2HDAC3HDAC4HDAC1
SCHEMBL2669345 0.81 HDAC1 (0.47) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2669487 0.81 HDAC1 (0.47) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL9071910 0.80 CCNE1 (0.47) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL2666164 0.79 CCNE1 (0.69) CCND3CCNE1CDK2CCNE2CCNB2
SCHEMBL2668627 0.78 MAOB (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2668616 0.77 HDAC1 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2668621 0.77 GLS (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10253052 0.76 SMN1; SMN2 (0.65) MAPK10SMN1; SMN2LMNARAB9A

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-2007006814-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-18 — — WO disclosed
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