SCHEMBL4229043

SCHEMBL4229043

COc1cc(N)ccc1OC1CCNC1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 13/20 0.49
HTR2B P41595 13/20 0.49
PDE4B Q07343 1/20 0.49
HTR1A P08908 1/20 0.46
SLC6A2 P23975 1/20 0.46
PRKCZ Q05513 1/20 0.44
PIK3CA P42336 1/20 0.43

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
SCHEMBL4216952 0.92 PDE4B (0.50) HTR2CHTR2BPDE4B
SCHEMBL15650817 0.91 PDE4B (0.48) HTR2CPDE4BHTR1ASLC6A2PRKCZ
SCHEMBL5835805 0.81 MAP2K1 (0.51) HTR2CHTR2BHTR1ASLC6A2PRKCZ
SCHEMBL5835326 0.81 MAP2K1 (0.51) HTR2CHTR2BHTR1ASLC6A2PRKCZ
SCHEMBL4119970 0.80 SLC6A2 (0.48) HTR2CHTR2BPDE4BHTR1ASLC6A2
SCHEMBL8271827 0.80 SLC6A2 (0.63) HTR2CHTR2BPDE4BHTR1ASLC6A2
SCHEMBL8271831 0.80 SLC6A2 (0.63) HTR2CHTR2BPDE4BHTR1ASLC6A2
SCHEMBL9670802 0.80 SLC6A2 (0.63) HTR2CHTR2BPDE4BHTR1ASLC6A2
Hydrochloric Acid SCHEMBL4133478 0.78 SLC6A2 (0.61) HTR2CHTR2BPDE4BHTR1ASLC6A2
Hydrochloric Acid SCHEMBL4129951 0.78 SLC6A2 (0.61) HTR2CHTR2BPDE4BHTR1ASLC6A2

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-8263772-B2 MCH receptor antagonists ELI LILLY AND COMPANY (US) 2012-09-11 US disclosed
US-20090093456-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2009-04-09 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-20090093456-A1 NOVEL MCH RECEPTOR ANTAGONISTS MCHR1, MCHR2, MC1R HTR2C 223/4885HTR2B 236/4885PDE4B 1851/4885

“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.