SCHEMBL6209173

SCHEMBL6209173

COc1ccc2oc(=O)cc(NC3CCN(Cc4ccc(OCCCN5CCCCC5)c(F)c4)CC3)c2c1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 14/20 0.62
KCNH2 Q12809 4/20 0.55
HTR1A P08908 3/20 0.51
DRD2 P14416 3/20 0.51
HTR2A P28223 3/20 0.51
HRH3 Q9Y5N1 3/20 0.51
NSD2 O96028 1/20 0.46
EHMT2 Q96KQ7 1/20 0.46

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
SCHEMBL6208695 0.91 MCHR1 (0.62) MCHR1KCNH2HTR1ADRD2HTR2A
SCHEMBL6188905 0.88 MCHR1 (0.73) MCHR1KCNH2
SCHEMBL6188949 0.83 MCHR1 (0.73) MCHR1KCNH2HTR1A
SCHEMBL6188912 0.83 MCHR1 (0.72) MCHR1KCNH2HTR1A
SCHEMBL6187993 0.83 MCHR1 (0.72) MCHR1KCNH2
Trifluoroacetic Acid SCHEMBL6190985 0.83 MCHR1 (0.65) MCHR1KCNH2
Hydrochloric Acid SCHEMBL6189116 0.82 MCHR1 (0.71) MCHR1KCNH2HTR1A
SCHEMBL6188162 0.81 MCHR1 (0.80) MCHR1KCNH2
SCHEMBL6308582 0.81 MCHR1 (0.66) MCHR1KCNH2HRH3
SCHEMBL6192543 0.81 MCHR1 (0.71) MCHR1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6921821-B2 Antagonists of melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2005-07-26 US claimed
US-20040106645-A1 Antagonists of melanin concentrating hormone receptor MILLENNIUM PHARMACEUTICALS, INC. 2004-06-03 US claimed
US-6921821-B2 Antagonists of melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2005-07-26 US disclosed
EP-1534703-A2 ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR ABBOTT LABORATORIES (US) 2005-06-01 EP disclosed
US-20040106645-A1 Antagonists of melanin concentrating hormone receptor MILLENNIUM PHARMACEUTICALS, INC. 2004-06-03 US disclosed
WO-2003106452-A2 ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-12-24 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-20040106645-A1 Antagonists of melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885KCNH2 2839/4885HTR1A 103/4885

“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.