SCHEMBL11666708

SCHEMBL11666708

CC(O)N1CC(c2ccccc2)NC1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
BRD4 O60885 4/20 0.40
LMNA P02545 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
ALOX5 P09917 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MAPT P10636 2/20 0.36
TSHR P16473 1/20 0.36
HSD17B2 P37059 1/20 0.36
USP2 O75604 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL20780438 0.88 KMT2A (0.42) KMT2AMEN1BRD4LMNAADORA3
SCHEMBL20794403 0.75 BRD4 (0.49) KMT2AMEN1BRD4LMNAADORA3
SCHEMBL13413551 0.75 BRD4 (0.49) KMT2AMEN1BRD4LMNAADORA3
SCHEMBL20780479 0.72 L3MBTL1 (0.36) LMNAL3MBTL1
SCHEMBL20780437 0.72 SRD5A1 (0.39) TDP1MAPT
SCHEMBL20794437 0.72 CYP2C19 (0.46) KMT2AMEN1SMN1; SMN2TSHR
SCHEMBL28843260 0.72 MEN1 (0.45) KMT2AMEN1BRD4ALOX5SMN1; SMN2
SCHEMBL28843263 0.72 MEN1 (0.45) KMT2AMEN1BRD4ALOX5SMN1; SMN2
SCHEMBL13394539 0.71 LMNA (0.50) KMT2AMEN1BRD4LMNAADORA3
SCHEMBL13395507 0.71 BRD4 (0.41) KMT2AMEN1BRD4LMNAADORA3

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-4087611-A CHEMICAL INTERMEDIATES AMERICAN CYANAMID COMPANY (US) 1978-05-02 US disclosed