SCHEMBL3494873

SCHEMBL3494873

CCN1C(=O)CC2(CCN(C(=O)OC(C)(C)C)CC2)OC1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
GPR119 Q8TDV5 6/20 0.40
KMT2A Q03164 1/20 0.40
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPGD P15428 1/20 0.36
KLK7 P49862 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL3493469 0.80 MEN1 (0.45) GPR119KMT2AKDM4EALDH1A1NPSR1
SCHEMBL31189134 0.79 USP2 (0.47) SMN1; SMN2USP2GPR119KMT2ACHRM2
SCHEMBL3493554 0.78 KMT2A (0.44) GPR119KMT2AKDM4EALDH1A1NPSR1
SCHEMBL3493829 0.78 GPR119 (0.44) SMN1; SMN2USP2GPR119KMT2ADDB1
SCHEMBL7840359 0.76 USP2 (0.45) SMN1; SMN2USP2GPR119DDB1CRBN
SCHEMBL3035597 0.76 USP2 (0.45) SMN1; SMN2USP2GPR119DDB1CRBN
SCHEMBL22911795 0.75 USP2 (0.44) SMN1; SMN2USP2GPR119KMT2ADDB1
SCHEMBL15166535 0.75 USP2 (0.44) SMN1; SMN2USP2GPR119KMT2ACHRM2
SCHEMBL14720194 0.74 USP2 (0.40) SMN1; SMN2USP2GPR119DDB1CRBN
SCHEMBL371222 0.74 USP2 (0.45) SMN1; SMN2USP2GPR119KMT2ADDB1

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 SMN1; SMN2 889/4885USP2 3819/4885GPR119 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.