SCHEMBL835762

SCHEMBL835762

CC(C)(C)OC(=O)N1CCC(C(=O)N2Cc3cccc(C#N)c3C2)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.50
RECQL P46063 1/20 0.48
GPR119 Q8TDV5 8/20 0.48
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
NAMPT P43490 1/20 0.46
STS P08842 2/20 0.45
PTPN2 P17706 1/20 0.45
PTPN1 P18031 1/20 0.45
PTPN6 P29350 1/20 0.45
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
UCHL1 P09936 1/20 0.43
MAPK1 P28482 1/20 0.42

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
SCHEMBL833367 0.88 ALDH1A1 (0.53) HPGDGPR119DDB1CRBNNAMPT
SCHEMBL3055188 0.86 DDB1 (0.52) GPR119DDB1CRBNNAMPTUCHL1
SCHEMBL31420680 0.86 DDB1 (0.52) GPR119DDB1CRBNNAMPTUCHL1
SCHEMBL30895649 0.84 HPGD (0.62) HPGDRECQLGPR119NAMPTSTS
SCHEMBL26130562 0.84 HPGD (0.62) HPGDRECQLGPR119NAMPTSTS
SCHEMBL1867980 0.83 HPGD (0.50) HPGDRECQLGPR119DDB1CRBN
SCHEMBL834021 0.82 UCHL1 (0.64) DDB1CRBNNAMPTUCHL1
SCHEMBL2121713 0.81 ESR2 (0.52) GPR119DDB1CRBNNAMPTUCHL1
SCHEMBL7641200 0.81 ESR2 (0.52) GPR119DDB1CRBNNAMPTUCHL1
SCHEMBL24265580 0.79 MAPK1 (0.49) GPR119DDB1CRBNNAMPTUCHL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143284-B2 2-cyclohexyl-3-oxo-2,3-dihydro-1H-isoindole-4-carboxamide; allergic encephalitis, arthritis, cardiac and kidney toxicities from doxorubicin-based and platinum-based antineoplastic agents, carcinoma of the breast, central nervous system inflammation, cervical carcinoma, ABBOTT LABORATORIES (US) 2012-03-27 US disclosed
US-20080108659-A1 POLY(ADP-RIBOSE)POLYMERASE INHIBITORS ABBVIE INC. 2008-05-08 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-20080108659-A1 POLY(ADP-RIBOSE)POLYMERASE INHIBITORS PARP1, PARP11, PARP2 HPGD 513/4885RECQL 126/4885GPR119 2169/4885

“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.