SCHEMBL2728583

SCHEMBL2728583

CC(C)(C)OC(=O)N1CC2CC2(c2ccc(N3CCCC3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.47
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
RORC P51449 2/20 0.41
PDK2 Q15119 1/20 0.40
MGLL Q99685 1/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
NAMPT P43490 1/20 0.40
TGFBR1 P36897 1/20 0.39
MEN1 O00255 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL10132382 0.99 GPR119 (0.46) GPR119ALDH1A1LMNAMAPTRORC
SCHEMBL2713151 0.91 GPR119 (0.49) GPR119ALDH1A1LMNAMAPTRORC
SCHEMBL9951786 0.91 GPR119 (0.49) GPR119ALDH1A1LMNAMAPTRORC
SCHEMBL2727269 0.91 GPR119 (0.55) GPR119ALDH1A1LMNAMAPTRORC
SCHEMBL2712292 0.90 GPR119 (0.45) GPR119ALDH1A1LMNAMAPTRORC
SCHEMBL2727935 0.87 GPR119 (0.47) GPR119ALDH1A1LMNAMAPTRORC
SCHEMBL2728940 0.84 GPR119 (0.42) GPR119ALDH1A1LMNAMAPTRORC
SCHEMBL10132386 0.84 MAPT (0.47) ALDH1A1LMNAMAPTPDK2MGLL
SCHEMBL2727537 0.84 ALDH1A1 (0.41) ALDH1A1MAPTRORCMGLL
SCHEMBL23752795 0.83 MGLL (0.54) RORCMGLL

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-8906913-B2 Azabicyclohexanes PANACEA BIOTEC LIMITED (IN) 2014-12-09 US disclosed
EP-2445887-B1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD (IN) 2014-11-05 EP disclosed
US-20120165320-A1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2012-06-28 US disclosed
EP-2445887-A2 NOVEL AZABICYCLOHEXANES Panacea Biotec Limited (IN) 2012-05-02 EP disclosed
WO-2010150281-A2 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2010-12-29 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-20120165320-A1 NOVEL AZABICYCLOHEXANES CYP3A43, UGT1A1, CYP3A4 GPR119 1235/4885ALDH1A1 295/4885LMNA 3476/4885

“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.