SCHEMBL7325969

SCHEMBL7325969

CCOC(=O)CC1C(=O)NCCN1C(=O)OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.65
KMT2A Q03164 3/20 0.64
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
MEN1 O00255 1/20 0.56
RAB9A P51151 1/20 0.56
ATM Q13315 1/20 0.56
POLB P06746 2/20 0.54
MAPT P10636 1/20 0.54
GLA P06280 1/20 0.54
KDM4E B2RXH2 1/20 0.52
LMNA P02545 2/20 0.51

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
SCHEMBL12189896 0.88 KMT2A (0.55) ALDH1A1KMT2ARAB9AGLAKDM4E
SCHEMBL28899278 0.88 KMT2A (0.55) ALDH1A1KMT2ARAB9AGLAKDM4E
SCHEMBL4387733 0.88 KMT2A (0.55) ALDH1A1KMT2ARAB9AGLAKDM4E
SCHEMBL4385603 0.86 KMT2A (0.52) ALDH1A1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL4389072 0.85 KMT2A (0.53) ALDH1A1KMT2AMEN1RAB9AMAPT
SCHEMBL4392704 0.84 PSEN1 (0.58) ALDH1A1KMT2ACYP2C19RAB9AGLA
SCHEMBL4315505 0.83 KMT2A (0.52) ALDH1A1KMT2AMAPTGLAKDM4E
SCHEMBL4064196 0.83 KMT2A (0.53) ALDH1A1KMT2AGLAKDM4ELMNA
SCHEMBL4064197 0.83 KMT2A (0.53) ALDH1A1KMT2AGLAKDM4ELMNA
SCHEMBL288165 0.83 USP2 (0.50) ALDH1A1

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-6204268-B1 CYCLIC DIAZA COMPOUNDS COR THERAPEUTICS, INC 2001-03-20 US disclosed
EP-0977772-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 2000-02-09 EP disclosed
WO-1998046626-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 1998-10-22 WO disclosed