SCHEMBL6701446

SCHEMBL6701446

CC1(NC(=O)OC(C)(C)C)CCN(c2cc(Cl)ncn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RET P07949 13/20 0.45
RAF1 P04049 1/20 0.39
GPR119 Q8TDV5 2/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
HRH4 Q9H3N8 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
LMNA P02545 1/20 0.34
DRD2 P14416 1/20 0.34

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
SCHEMBL29686486 0.82 RET (0.47) RETRAF1
SCHEMBL20069375 0.82 RET (0.47) RETRAF1
SCHEMBL7391819 0.80 TRPV1 (0.44) RETRAF1GPR119
SCHEMBL7395341 0.79 RET (0.45) RETRAF1
SCHEMBL7394635 0.79 HTR3E (0.46) RETRAF1CNR1CNR2
SCHEMBL6700495 0.78 GPR119 (0.54) RETGPR119HRH3LMNA
SCHEMBL8512837 0.78 CKS1B (0.55) RETGPR119CNR1CNR2DRD2
SCHEMBL24879320 0.77 RET (0.47) RETRAF1GPR119
SCHEMBL30111209 0.77 RET (0.47) RETRAF1GPR119
SCHEMBL30194848 0.77 RET (0.47) RETRAF1GPR119

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-20040180925-A1 Dipeptidylpeptidase-IV inhibitor KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-09-16 US disclosed
EP-1354882-A1 DIPEPTIDYL PEPTIDASE IV INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-10-22 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-20040180925-A1 Dipeptidylpeptidase-IV inhibitor DPP4, DPP3, DPP9 RET 3084/4885RAF1 3843/4885GPR119 111/4885

“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.