SCHEMBL21413281

SCHEMBL21413281

CCCC1NC(=O)CC12CCN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 2/20 0.43
▸ CRBN Q96SW2 2/20 0.43
▸ GPR119 Q8TDV5 6/20 0.41
▸ NAMPT P43490 7/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ TACR1 P25103 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ SMN1; SMN2 Q16637 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
SCHEMBL17101527 0.90 DDB1 (0.45) DDB1CRBNGPR119NAMPTKDM4E
SCHEMBL30327907 0.81 DDB1 (0.44) DDB1CRBNGPR119NAMPTKDM4E
SCHEMBL18075963 0.73 CHRM4 (0.45) NAMPT
SCHEMBL23145355 0.72 USP2 (0.45) DDB1CRBNGPR119NAMPTKDM4E
SCHEMBL13617698 0.72 GPR119 (0.41) DDB1CRBNGPR119NAMPT
SCHEMBL5557834 0.71 SLC6A9 (0.47) DDB1CRBNGPR119NAMPTKDM4E
SCHEMBL25547332 0.71 GPR119 (0.60) GPR119NAMPT
SCHEMBL7010905 0.71 USP2 (0.46) DDB1CRBNGPR119KDM4EMAPT
SCHEMBL769732 0.71 USP2 (0.46) DDB1CRBNGPR119KDM4EMAPT
SCHEMBL20942451 0.70 NEK2 (0.30) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10428088-B2 Muscarinic receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-10-01 — — 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-10428088-B2 Muscarinic receptor agonists CHRM1, CHRM2, CHRM3 DDB1 4415/4885CRBN 3770/4885GPR119 132/4885

“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.

Send feedback