SCHEMBL4126397

SCHEMBL4126397

CC(C)(C)OC(=O)NC[C@@H]1C[C@H]1c1ccccc1N

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.41
ACACB O00763 5/20 0.40
MTNR1B P49286 4/20 0.40
HTR2C P28335 2/20 0.40
HTR2B P41595 2/20 0.40
HTR2A P28223 1/20 0.40
ACACA Q13085 3/20 0.39
IDO1 P14902 1/20 0.39
HDAC1 Q13547 1/20 0.39
NAMPT P43490 1/20 0.39
KDM1A O60341 1/20 0.38
MAOB P27338 1/20 0.38
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
MTNR1A P48039 3/20 0.38
KDM4A O75164 1/20 0.38

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
SCHEMBL4126395 1.00 DRD2 (0.41) DRD2ACACBMTNR1BHTR2CHTR2B
SCHEMBL17985446 0.86 HTR2A (0.50) DRD2ACACBMTNR1BHTR2CHTR2B
SCHEMBL4134674 0.85 HTR2C (0.50) DRD2ACACBMTNR1BHTR2CHTR2B
SCHEMBL4134676 0.85 HTR2C (0.50) DRD2ACACBMTNR1BHTR2CHTR2B
SCHEMBL13742538 0.84 MTNR1B (0.41) DRD2ACACBMTNR1BACACAIDO1
SCHEMBL13742044 0.84 ACACB (0.43) DRD2ACACBMTNR1BACACAIDO1
SCHEMBL13742060 0.82 HTR2C (0.53) DRD2ACACBHTR2CHTR2BHTR2A
SCHEMBL4131902 0.80 HTR2C (0.54) DRD2ACACBMTNR1BHTR2CACACA
SCHEMBL13695273 0.80 MTNR1B (0.39) DRD2ACACBMTNR1BACACAIDO1
SCHEMBL8273612 0.80 HTR2C (0.46) DRD2ACACBMTNR1BHTR2CHTR2B

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-20090203750-A1 5-HT2C Receptor Agonists as Anorectic Agents NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-08-13 US disclosed
WO-2007025144-A1 5-HT2C RECEPTOR AGONISTS AS ANORECTIC AGENTS UNIVERSITY OF ILLINOIS - CHICAGO (US) 2007-03-01 WO 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-20090203750-A1 5-HT2C Receptor Agonists as Anorectic Agents HTR2C, HTR2A, HTR5A DRD2 225/4885ACACB 1998/4885MTNR1B 228/4885

“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.