SCHEMBL20158970

SCHEMBL20158970

CCN1C[C@H](O)C[C@H]1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.40
MAOB P27338 3/20 0.40
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.36
GRM2 Q14416 1/20 0.35
GAA P10253 1/20 0.32
DPP4 P27487 2/20 0.30
DPP8 Q6V1X1 2/20 0.30
DPP9 Q86TI2 2/20 0.30
APEX1 P27695 1/20 0.30
BLM P54132 1/20 0.30
PIK3CD O00329 1/20 0.30

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
SCHEMBL20158969 1.00 MAOA (0.40) MAOAMAOBATMSMN1; SMN2GRM2
SCHEMBL30148983 1.00 MAOA (0.40) MAOAMAOBATMSMN1; SMN2GRM2
SCHEMBL30168200 0.85 MAOA (0.38) MAOAMAOBATMSMN1; SMN2GRM2
SCHEMBL8895922 0.82 ATM (0.53) ATMGAA
SCHEMBL25485065 0.82 MAOA (0.40) MAOAMAOBATMGRM2APEX1
SCHEMBL5067978 0.82 ATM (0.53) ATMGAA
SCHEMBL21290883 0.82 ATM (0.53) ATMGAA
SCHEMBL7267129 0.82 OGA (0.38) MAOAMAOBATMGAA
SCHEMBL7267134 0.82 OGA (0.38) MAOAMAOBATMGAA
SCHEMBL19293080 0.81

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-20180134690-A1 INDAZOLES AND USE THEREOF PURDUE PHARMA LP (US) 2018-05-17 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-20180134690-A1 INDAZOLES AND USE THEREOF TRPV3, TRPA1, TRPV1 MAOA 2268/4885MAOB 1323/4885ATM 3968/4885

“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.