SCHEMBL13878427

SCHEMBL13878427

CNCCC[Si](O[Si](CCCNC(=O)c1cccc(C(=O)NCCC[Si](O[Si](CCCN)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)c1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GRIN1 Q05586 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ GRIN2B Q13224 1/20 0.42
▸ BRD4 O60885 3/20 0.41
▸ HDAC1 Q13547 2/20 0.41
▸ HDAC2 Q92769 2/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ NAAA Q02083 1/20 0.40
▸ HDAC3 O15379 1/20 0.40
▸ HDAC4 P56524 1/20 0.40
▸ HDAC7 Q8WUI4 1/20 0.40
▸ HDAC10 Q969S8 1/20 0.40
▸ HDAC11 Q96DB2 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ HDAC9 Q9UKV0 1/20 0.40
▸ HDAC5 Q9UQL6 1/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39

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
SCHEMBL13878428 0.85 SMN1; SMN2 (0.52) SMN1; SMN2HDAC1HDAC2PAX8NAAA
SCHEMBL16151772 0.75 SMN1; SMN2 (0.69) SMN1; SMN2GRIN1GRIN2AGRIN2BHDAC1
SCHEMBL9321269 0.73 SMN1; SMN2 (0.67) SMN1; SMN2GRIN1GRIN2AGRIN2BHDAC1
Hydrochloric Acid SCHEMBL16428996 0.73 SMN1; SMN2 (0.67) SMN1; SMN2GRIN1GRIN2AGRIN2BHDAC1
SCHEMBL13878432 0.73 SMN1; SMN2 (0.52) SMN1; SMN2HDAC1HDAC2PAX8MEN1
SCHEMBL126332 0.73 HTR2A (0.42) SMN1; SMN2
SCHEMBL13878430 0.72 PGR (0.46) SMN1; SMN2HDAC1HDAC2PAX8HDAC3
SCHEMBL8351454 0.72 SMN1; SMN2 (0.61) SMN1; SMN2GRIN1GRIN2AGRIN2BBRD4
SCHEMBL15985414 0.72 SMN1; SMN2 (0.54) SMN1; SMN2HDAC1HDAC2NAAAMEN1
SCHEMBL15985358 0.72 SMN1; SMN2 (0.54) SMN1; SMN2HDAC1HDAC2NAAAHDAC3

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-20090111050-A1 Novel Photosensitive Resin Compositions FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2009-04-30 — — US disclosed
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