SCHEMBL3495197

SCHEMBL3495197

CCN1CCC2(CCN(C(=O)OC(C)(C)C)CC2)CC1=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GPR119 Q8TDV5 7/20 0.41
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
NAMPT P43490 1/20 0.39
CYP11B2 P19099 1/20 0.38
ACACB O00763 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
SCD5 Q86SK9 1/20 0.37

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
SCHEMBL10111390 0.90 USP2 (0.41) USP2SMN1; SMN2GPR119DDB1CRBN
SCHEMBL16862352 0.83 OPRD1 (0.52) USP2GPR119SCD5
SCHEMBL599707 0.80 NAMPT (0.39) USP2SMN1; SMN2GPR119NAMPTCYP11B2
SCHEMBL904136 0.79 USP2 (0.49) USP2SMN1; SMN2GPR119DDB1CRBN
SCHEMBL29921574 0.79 CYP11B2 (0.44) USP2SMN1; SMN2GPR119NAMPTCYP11B2
SCHEMBL25967353 0.79 USP2 (0.43) USP2SMN1; SMN2GPR119NAMPTCYP11B2
SCHEMBL14297530 0.78 USP2 (0.45) USP2SMN1; SMN2GPR119DDB1CRBN
SCHEMBL21285082 0.78 USP2 (0.47) USP2SMN1; SMN2GPR119DDB1CRBN
SCHEMBL20353659 0.78 CYP2D6 (0.48) USP2SMN1; SMN2GPR119SCD5
SCHEMBL12447685 0.77 OPRD1 (0.51) USP2GPR119CYP11B2SCD5

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-20100113418-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-06 US disclosed
US-20100113418-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-06 US disclosed
US-20100113418-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-06 US disclosed
EP-2123652-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-11-25 EP 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-20100113418-A1 HETEROCYCLIC COMPOUND ACACA, ACAT1, CPT1B USP2 3819/4885SMN1; SMN2 889/4885GPR119 25/4885

“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.