SCHEMBL5548376

SCHEMBL5548376

CC(C)(C)OC(=O)N[C@@H]1CC[C@H](CSc2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.52
MAOB P27338 1/20 0.52
DRD2 P14416 8/20 0.52
KMT2A Q03164 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
BTK Q06187 3/20 0.46
EPHX2 P34913 1/20 0.44
KCNA3 P22001 1/20 0.43
DRD3 P35462 1/20 0.43
AGTR2 P50052 1/20 0.41
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL5548792 1.00 KDM1A (0.52) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL5545060 1.00 KDM1A (0.52) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL5543298 0.88 DRD2 (0.45) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL5548373 0.83 DRD2 (0.48) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL6643254 0.83 KMT2A (0.53) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL5550028 0.82 DRD2 (0.46) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL3904285 0.81 KMT2A (0.59) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL21089801 0.81 KMT2A (0.59) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL8890088 0.81 DRD2 (0.54) DRD2CKS1BSKP1SKP2
SCHEMBL8890092 0.81 DRD2 (0.54) DRD2CKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050192324-A1 Novel dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof GLENMARK PHARMACEUTICALS LTD. (IN) 2005-09-01 US claimed
US-7230002-B2 Dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof GLENMARK PHARMACEUTICALS LTD. (IN) 2007-06-12 US disclosed
US-20050192324-A1 Novel dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof GLENMARK PHARMACEUTICALS LTD. (IN) 2005-09-01 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-20050192324-A1 Novel dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof DPP4, DPP3, DPP7 KDM1A 2466/4885MAOB 2337/4885DRD2 3398/4885

“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.