SCHEMBL11141024

SCHEMBL11141024

CCOC(=O)NCCOCCNC(=O)OCC

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 12/20 0.52
L3MBTL1 Q9Y468 1/20 0.50
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KMT2A Q03164 2/20 0.46
GLA P06280 1/20 0.46
MEN1 O00255 1/20 0.45

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
SCHEMBL9493874 0.94 ACHE (0.52) ACHEL3MBTL1LMNASMN1; SMN2
SCHEMBL27357775 0.94 ACHE (0.47) ACHEL3MBTL1LMNASMN1; SMN2KMT2A
SCHEMBL27357778 0.94 ACHE (0.47) ACHEL3MBTL1LMNASMN1; SMN2KMT2A
SCHEMBL26460411 0.94 ACHE (0.47) ACHEL3MBTL1LMNASMN1; SMN2KMT2A
SCHEMBL9495238 0.93 ACHE (0.50) ACHEL3MBTL1LMNASMN1; SMN2KMT2A
SCHEMBL24854772 0.92 ACHE (0.50) ACHEL3MBTL1LMNASMN1; SMN2KMT2A
SCHEMBL22138601 0.92 ACHE (0.46) ACHEL3MBTL1LMNASMN1; SMN2KMT2A
SCHEMBL9494648 0.90 ACHE (0.58) ACHE
SCHEMBL8142038 0.90 L3MBTL1 (0.48) ACHEL3MBTL1LMNASMN1; SMN2KMT2A
SCHEMBL24990592 0.90 L3MBTL1 (0.44) ACHEL3MBTL1LMNASMN1; SMN2KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4417896-A NITRO-,AMINO-,PHENOXYALKANOLS SOCIETE ANONYME DITE: L'OREAL (FR) 1983-11-29 US disclosed
US-4337061-A NITRO DYES IN AQUEOUS SOLUTION SOCIETE ANONYME DITE: L'OREAL (FR) 1982-06-29 US disclosed
US-4311478-A HAIR DYES L'OREAL (FR) 1982-01-19 US disclosed