SCHEMBL3332689

SCHEMBL3332689

CC(C)(C)CC1(O)CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP11B2 P19099 1/20 0.39
USP30 Q70CQ3 1/20 0.38
NR1H2 P55055 1/20 0.38
SCD5 Q86SK9 1/20 0.37
HPGD P15428 1/20 0.37
EPHX2 P34913 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
ACACB O00763 2/20 0.36
CTSK P43235 1/20 0.36
RORC P51449 1/20 0.35
RECQL P46063 1/20 0.35
EPHX1 P07099 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
SCHEMBL23120624 0.87 USP2 (0.43) USP2SMN1; SMN2NR1H2HPGDEPHX2
SCHEMBL16553663 0.86 USP2 (0.44) USP2SMN1; SMN2CYP11B2USP30NR1H2
SCHEMBL24012274 0.86 USP2 (0.44) USP2SMN1; SMN2CYP11B2USP30NR1H2
SCHEMBL3318268 0.84 CYP4F2 (0.45) USP2SMN1; SMN2CYP11B2USP30NR1H2
SCHEMBL9773945 0.84 USP2 (0.42) USP2SMN1; SMN2CYP11B2USP30NR1H2
SCHEMBL31447849 0.83 USP2 (0.41) USP2SMN1; SMN2CYP11B2USP30NR1H2
SCHEMBL30855264 0.82 CYP4F2 (0.49) USP2SMN1; SMN2CYP11B2USP30NR1H2
SCHEMBL25169698 0.81 USP2 (0.43) USP2SMN1; SMN2CYP11B2HPGDEPHX2
SCHEMBL31447875 0.81 JAK2 (0.43) USP2SMN1; SMN2CTSK
SCHEMBL17763768 0.81 USP2 (0.40) USP2SMN1; SMN2CYP11B2USP30NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137305-A1 AMINOPYRIMIDINES USEFUL AS KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-03 US disclosed
EP-2142537-A2 AMINOPYRIMIDINES USEFUL AS KINASE INHIBITORS Vertex Pharmaceuticals Incorporated (US) 2010-01-13 EP disclosed
WO-2008115973-A2 AMINOPYRIMIDINES USEFUL AS KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-09-25 WO disclosed
WO-2008115973-A2 AMINOPYRIMIDINES USEFUL AS KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-09-25 WO 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-20100137305-A1 AMINOPYRIMIDINES USEFUL AS KINASE INHIBITORS AURKC, AURKA, AURKB USP2 3421/4885SMN1; SMN2 2078/4885CYP11B2 2802/4885

“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.