SCHEMBL4129039

SCHEMBL4129039

CC(C)(C)OC(=O)NCC1CC1c1cccc(-c2cccc(Cl)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.46
HTR2A P28223 2/20 0.45
HTR2B P41595 2/20 0.45
CNR1 P21554 1/20 0.42
DRD2 P14416 2/20 0.41
CTSL P07711 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ACACB O00763 4/20 0.40
ACACA Q13085 3/20 0.40
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.38
TP53 P04637 3/20 0.38
MDM2 Q00987 3/20 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
SCHEMBL4129040 1.00 HTR2C (0.46) HTR2CHTR2AHTR2BCNR1DRD2
SCHEMBL5315744 0.94 HTR2C (0.42) HTR2CHTR2AHTR2BCNR1DRD2
SCHEMBL4129091 0.93 HTR2C (0.56) HTR2CHTR2AHTR2BCNR1DRD2
SCHEMBL4129089 0.93 HTR2C (0.56) HTR2CHTR2AHTR2BCNR1DRD2
SCHEMBL5315275 0.87 HTR2C (0.50) HTR2CHTR2AHTR2BCNR1DRD2
SCHEMBL4134705 0.86 DRD2 (0.43) HTR2CCNR1DRD2KDM4EACACB
SCHEMBL4134708 0.86 DRD2 (0.43) HTR2CCNR1DRD2KDM4EACACB
SCHEMBL4127041 0.86 HTR2C (0.56) HTR2CHTR2AHTR2BDRD2ACACB
SCHEMBL4127039 0.86 HTR2C (0.56) HTR2CHTR2AHTR2BDRD2ACACB
SCHEMBL4138978 0.84 HTR2C (0.43) HTR2CHTR2AHTR2BACACBACACA

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 HTR2C 1/4885HTR2A 2/4885HTR2B 4/4885

“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.