SCHEMBL4026764

SCHEMBL4026764

CC(C)(C)OC(=O)[CH]N1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CTSK P43235 2/20 0.37
PREP P48147 2/20 0.35
EPHX1 P07099 1/20 0.33
EPHX2 P34913 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
ELANE P08246 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DGAT1 O75907 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
GPR119 Q8TDV5 1/20 0.31

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
SCHEMBL303433 0.98 HPGD (0.41) HPGDUSP2SMN1; SMN2CTSKPREP
SCHEMBL4180059 0.96 CTSK (0.41) HPGDUSP2SMN1; SMN2CTSKPREP
SCHEMBL3582549 0.84 USP2 (0.33) HPGDUSP2SMN1; SMN2CTSK
SCHEMBL6166737 0.79 HPGD (0.37) HPGDUSP2SMN1; SMN2CTSKPREP
SCHEMBL22684497 0.75 HCAR2 (0.43) HPGDUSP2SMN1; SMN2L3MBTL1
SCHEMBL2014178 0.71 NOTUM (0.46)
SCHEMBL5115378 0.70 HCAR2 (0.43) HPGDSMN1; SMN2L3MBTL1
SCHEMBL3577281 0.69 MAPK10 (0.38) HPGDUSP2SMN1; SMN2CTSKEPHX1
SCHEMBL28839099 0.68 TSHR (0.35) HPGDUSP2SMN1; SMN2CTSKEPHX1
SCHEMBL900812 0.68 CTSK (0.67) HPGDUSP2SMN1; SMN2CTSKPREP

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-9550737-B2 TNF -α modulating benzimidazoles UCB BIOPHARMA SPRL (BE) 2017-01-24 US disclosed
US-20150152065-A1 TNF -Alpha Modulating Benzimidazoles UCB BIOPHARMA SPRL (BE) 2015-06-04 US disclosed
EP-2858983-A1 TNF -ALPHA MODULATING BENZIMIDAZOLES UCB Biopharma SPRL (BE) 2015-04-15 EP disclosed
WO-2013186229-A1 TNF -ALPHA MODULATING BENZIMIDAZOLES UCB PHARMA S.A. (BE) 2013-12-19 WO disclosed
WO-2009093009-A1 FUSED TRICYCLIC THIOPHENE DERIVATIVES AS MEK INHIBITORS UCB PHARMA S.A. (BE) 2009-07-30 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-20150152065-A1 TNF -Alpha Modulating Benzimidazoles TNF, TNFRSF1A, NFKBIA HPGD 1362/4885USP2 2937/4885SMN1; SMN2 674/4885

“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.