SCHEMBL2881610

SCHEMBL2881610

O=c1cc(C=Cc2ccc(F)cc2)ccn1CCc1ccc(CN2CC[C@H](F)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 6/20 0.50
ACHE P22303 3/20 0.39
BCHE P06276 2/20 0.39
BACE1 P56817 2/20 0.39
GRM2 Q14416 1/20 0.38
HRH3 Q9Y5N1 3/20 0.38
HTR2A P28223 3/20 0.37
HTR2C P28335 3/20 0.37
HTR7 P34969 2/20 0.37
HTR6 P50406 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2B P41595 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
KCNH2 Q12809 1/20 0.36
CCR3 P51677 1/20 0.36

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
SCHEMBL2881606 1.00 MCHR1 (0.50) MCHR1ACHEBCHEBACE1GRM2
SCHEMBL2876352 0.92 MCHR1 (0.41) MCHR1ACHEBCHEBACE1HRH3
SCHEMBL2876354 0.92 MCHR1 (0.41) MCHR1ACHEBCHEBACE1HRH3
SCHEMBL2876395 0.91 MCHR1 (0.42) MCHR1ACHEBCHEBACE1HRH3
SCHEMBL2876393 0.91 MCHR1 (0.42) MCHR1ACHEBCHEBACE1HRH3
SCHEMBL2881131 0.72 MCHR1 (0.67) MCHR1KCNH2
SCHEMBL2881734 0.72 MCHR1 (0.67) MCHR1KCNH2
SCHEMBL2881135 0.72 MCHR1 (0.67) MCHR1KCNH2
SCHEMBL2881733 0.72 MCHR1 (0.67) MCHR1KCNH2
SCHEMBL2886910 0.71 MCHR1 (0.56) MCHR1HRH3HTR7HTR6DRD2

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-20100216758-A1 Pyridone Compounds MSD K.K. (JP) 2010-08-26 US disclosed
EP-1916239-A1 PYRIDONE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-30 EP 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-20100216758-A1 Pyridone Compounds NPY1R, MC5R, MC1R MCHR1 4/4885ACHE 3052/4885BCHE 2805/4885

“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.