SCHEMBL312267

SCHEMBL312267

CC(C)(C)OC(=O)N1C2CCC1CC(Nc1ccc3[nH]ccc3c1)C2

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 1/20 0.52
SUV39H2 Q9H5I1 1/20 0.47
GPR119 Q8TDV5 8/20 0.47
JAK1 P23458 2/20 0.44
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
EPHX1 P07099 1/20 0.43
ALDH1A1 P00352 2/20 0.40
CHRNA7 P36544 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TRPV1 Q8NER1 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
SCHEMBL27478459 0.87 KAT2B (0.51) KAT2BSUV39H2GPR119JAK1CHRM2
SCHEMBL312418 0.83 ALDH1A1 (0.60) GPR119JAK1EPHX1ALDH1A1CHRNA7
SCHEMBL312715 0.81 ALDH1A1 (0.53) JAK1EPHX1ALDH1A1CHRNA7NPC1
SCHEMBL314219 0.80 USP30 (0.50) JAK1EPHX1ALDH1A1NPC1MAPT
SCHEMBL3524222 0.77 CHRM1 (0.55) KAT2BSUV39H2GPR119CHRM2CHRM1
SCHEMBL1974295 0.75 SUV39H2 (0.46) KAT2BSUV39H2GPR119JAK1CHRM2
SCHEMBL7461075 0.75 KMT2A (0.53) KAT2BSUV39H2GPR119CHRM2CHRM1
SCHEMBL3050576 0.74 PTPN2 (0.65) JAK1EPHX1ALDH1A1CHRNA7NPC1
SCHEMBL312970 0.71 KDM4E (0.60) ALDH1A1CHRNA7MAPTHTT
SCHEMBL4833481 0.71 NPC1 (0.54) EPHX1NPC1MAPTRAB9A

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-8093285-B2 Aminopiperidinyl derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2012-01-10 US disclosed
EP-2268631-A1 AMINOPIPERIDINYL DERIVATIVES AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2011-01-05 EP disclosed
WO-2009118254-A1 AMINOPIPERIDINYL DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2009-10-01 WO disclosed
US-20090247568-A1 AMINOPIPERIDINYL DERIVATIVES AND USES THEREOF ROCHE PALO ALTO LLC 2009-10-01 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-20090247568-A1 AMINOPIPERIDINYL DERIVATIVES AND USES THEREOF MAOB, ADORA2B, HTR1B KAT2B 2203/4885SUV39H2 2330/4885GPR119 420/4885

“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.