SCHEMBL9109950

SCHEMBL9109950

C[Si](C)(C)c1ccc(CCNNC(=O)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 16/20 0.52
HDAC1 Q13547 12/20 0.52
HDAC2 Q92769 10/20 0.52
ESRRG P62508 1/20 0.49
NCOR2 Q9Y618 5/20 0.48
HDAC6 Q9UBN7 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
HDAC8 Q9BY41 3/20 0.46

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
SCHEMBL9107032 0.85 HDAC3 (0.65) HDAC3HDAC1HDAC2ESRRGNCOR2
SCHEMBL2654333 0.82 HDAC3 (0.58) HDAC3HDAC1HDAC2ESRRGNCOR2
SCHEMBL9109090 0.81 HDAC3 (0.74) HDAC3HDAC1HDAC2NCOR2HDAC6
SCHEMBL9110617 0.80 HDAC3 (0.59) HDAC3HDAC1HDAC2NCOR2NPC1
SCHEMBL2995407 0.78 RAB9A (0.72) HDAC3HDAC1HDAC2HDAC6NPC1
SCHEMBL2652265 0.77 SMN1; SMN2 (0.59) HDAC3HDAC1HDAC2NCOR2HDAC6
SCHEMBL9110278 0.76 RAB9A (0.67) HDAC3HDAC1HDAC2HDAC6NPC1
SCHEMBL3237303 0.76 HDAC1 (0.65) HDAC3HDAC1HDAC2HDAC6NPC1
SCHEMBL9109405 0.75 HDAC3 (0.80) HDAC3HDAC1HDAC2NCOR2NPC1
SCHEMBL17141809 0.75 HDAC3 (0.83) HDAC3HDAC1HDAC2NCOR2HDAC6

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-0631571-A1 PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES. DU PONT (US) 1995-01-04 EP disclosed