SCHEMBL3748694

SCHEMBL3748694

CCOC(=O)C1(NC(=O)c2cnccn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.51
NPC1 O15118 8/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
KMT2A Q03164 3/20 0.51
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
PABPC1 P11940 1/20 0.48
HPGD P15428 2/20 0.47
KDM4E B2RXH2 3/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 3/20 0.44
USP2 O75604 1/20 0.44
GABRA1 P14867 1/20 0.43
LATS1 O95835 1/20 0.42

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
SCHEMBL1842772 0.80 PABPC1 (0.49) RAB9ANPC1SMN1; SMN2KMT2ATP53
SCHEMBL3742351 0.79 PABPC1 (0.56) RAB9ANPC1SMN1; SMN2KMT2ATP53
SCHEMBL22449364 0.77 GAA (0.56) RAB9ANPC1SMN1; SMN2KMT2ATP53
SCHEMBL2540067 0.77 BDKRB1 (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL26384821 0.75 RAB9A (0.41) RAB9ANPC1SMN1; SMN2KMT2APOLB
SCHEMBL21656898 0.73 GABRA1 (0.39) SMN1; SMN2KMT2AMEN1GABRA1LATS1
SCHEMBL4990188 0.72 NPC1 (0.55) RAB9ANPC1SMN1; SMN2KMT2ATP53
SCHEMBL464163 0.72 PABPC1 (0.52) RAB9ANPC1SMN1; SMN2TP53PABPC1
SCHEMBL5363367 0.72 BDKRB1 (0.46) SMN1; SMN2KMT2AMEN1GABRA1LATS1
SCHEMBL2558377 0.72 POLB (0.61) RAB9ANPC1SMN1; SMN2KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2212334-B1 PROTEASOME INHIBITORS MILLENNIUM PHARM INC (US) 2012-08-15 EP disclosed
US-7838673-B2 Proteasome inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-11-23 US disclosed
EP-2212334-A1 PROTEASOME INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2010-08-04 EP disclosed
WO-2009051581-A1 PROTEASOME INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-23 WO disclosed
US-20090099132-A1 Proteasome inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090099132-A1 Proteasome inhibitors PSMB5, PSMG3, PSMB1 RAB9A 2935/4885NPC1 1095/4885SMN1; SMN2 1033/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.