SCHEMBL13660267

SCHEMBL13660267

COC(=O)[C@H](C)NP(=O)(OC)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 12/20 0.53
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MAPK1 P28482 1/20 0.45
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.41
ELANE P08246 1/20 0.41

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
SCHEMBL25709714 1.00 BTN3A1 (0.53) BTN3A1KMT2AMEN1NPSR1MAPK1
SCHEMBL16576300 1.00 BTN3A1 (0.53) BTN3A1KMT2AMEN1NPSR1MAPK1
SCHEMBL16015972 0.95 BTN3A1 (0.56) BTN3A1KMT2AMEN1NPSR1MAPK1
SCHEMBL16153685 0.90 BTN3A1 (0.54) BTN3A1KMT2AMEN1NPSR1KDM4E
SCHEMBL16140840 0.90 BTN3A1 (0.54) BTN3A1KMT2AMEN1NPSR1KDM4E
SCHEMBL16140841 0.90 BTN3A1 (0.54) BTN3A1KMT2AMEN1NPSR1KDM4E
SCHEMBL16024774 0.90 BTN3A1 (0.54) BTN3A1KMT2AMEN1NPSR1KDM4E
SCHEMBL15588638 0.90 BTN3A1 (0.54) BTN3A1KMT2AMEN1NPSR1KDM4E
SCHEMBL13470529 0.90 BTN3A1 (0.54) BTN3A1KMT2AMEN1NPSR1KDM4E
SCHEMBL15721493 0.90 BTN3A1 (0.54) BTN3A1KMT2AMEN1NPSR1KDM4E

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-7605144-B2 Enzyme catalyzed therapeutic compounds CELMED ONCOLOGY (USA), INC. (CA) 2009-10-20 US disclosed