SCHEMBL4150540

SCHEMBL4150540

NC(=O)C1(C(=O)O)CC1c1ccc2ccccc2c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.40
MAOA P21397 2/20 0.40
MAOB P27338 2/20 0.40
PLAU P00749 2/20 0.40
PLG P00747 1/20 0.40
PLAT P00750 1/20 0.40
KLK1 P06870 1/20 0.40
RCOR1 Q9UKL0 4/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
GRM2 Q14416 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
PTPN1 P18031 1/20 0.37
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
EPHX1 P07099 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
SCHEMBL2401865 0.82 KDM1A (0.46) KDM1AMAOAMAOB
SCHEMBL4134868 0.78 KDM1A (0.48) KDM1ARCOR1HTR2CHTR2B
SCHEMBL4134001 0.77 KDM1A (0.47) KDM1ARCOR1GRM2HTR2CHTR2B
SCHEMBL28885376 0.77 SLC6A3 (0.44)
SCHEMBL307974 0.76 KDM1A (0.48) KDM1AMAOAMAOB
SCHEMBL4133969 0.75 KDM1A (0.44) KDM1AMAOAMAOBRCOR1
SCHEMBL4134830 0.75 KDM1A (0.41) KDM1AMAOAMAOBRCOR1
SCHEMBL8905787 0.73 F2 (0.40) PLAUPLGPLATKLK1
SCHEMBL5435422 0.71 MAPK1 (0.50) KDM1AMAOAMAOB
SCHEMBL28206522 0.70 KDM1A (0.43) KDM1AMAOAMAOB

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 KDM1A 3105/4885MAOA 666/4885MAOB 575/4885

“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.