SCHEMBL3005261

SCHEMBL3005261

COC(=O)C1(C)CC(C)(C)CN1C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BUB1 O43683 1/20 0.33
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.32
NR1H2 P55055 1/20 0.32
EPHX2 P34913 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
DGAT1 O75907 1/20 0.31
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
PTPN2 P17706 1/20 0.30
PTPN1 P18031 1/20 0.30
PTPN6 P29350 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL3005258 1.00 BUB1 (0.33) BUB1USP2SMN1; SMN2ALDH1A1NR1H2
SCHEMBL31751833 0.90 USP2 (0.34) BUB1USP2SMN1; SMN2NR1H2EPHX2
SCHEMBL15106078 0.85 GRIN2B (0.32) USP2SMN1; SMN2NR1H2EPHX2GRIN2B
SCHEMBL10174274 0.84 USP2 (0.34) BUB1USP2SMN1; SMN2NR1H2EPHX2
SCHEMBL28371753 0.84 USP2 (0.34) BUB1USP2SMN1; SMN2NR1H2EPHX2
SCHEMBL1268754 0.84 POLB (0.31) BUB1USP2SMN1; SMN2NR1H2
SCHEMBL14486969 0.79 GPR119 (0.36) USP2SMN1; SMN2NR1H2EPHX2GRIN2B
SCHEMBL18639721 0.78 USP2 (0.37) BUB1USP2SMN1; SMN2ALDH1A1NR1H2
SCHEMBL11954515 0.78 USP2 (0.38) USP2SMN1; SMN2ALDH1A1NR1H2EPHX2
SCHEMBL11954522 0.78 USP2 (0.38) USP2SMN1; SMN2ALDH1A1NR1H2EPHX2

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
US-8415340-B2 Triazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-09 US disclosed
EP-2175933-B1 TRIAZINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2012-08-22 EP disclosed
US-20100197654-A1 TRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-08-05 US disclosed
EP-2175933-A1 TRIAZINE KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2010-04-21 EP disclosed
WO-2009015254-A1 TRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-29 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-20100197654-A1 TRIAZINE KINASE INHIBITORS ABL1, STK25, FLT3 BUB1 209/4885USP2 1922/4885SMN1; SMN2 4667/4885

“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.