SCHEMBL2876396

SCHEMBL2876396

CCCNCc1ccc(CCn2ccc(/C=C/c3ccc(Cl)cc3)cc2=O)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.42
KCNH2 Q12809 2/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.41
HTR2A P28223 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CNR1 P21554 1/20 0.35
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35

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
SCHEMBL2876399 1.00 MCHR1 (0.42) MCHR1KCNH2LMNAGAAHTR2A
SCHEMBL2876691 0.87 LMNA (0.42) MCHR1LMNAGAAHDAC3HDAC1
SCHEMBL2883818 0.86 LMNA (0.41) MCHR1LMNAGAASMN1; SMN2NPSR1
SCHEMBL2883821 0.86 LMNA (0.41) MCHR1LMNAGAASMN1; SMN2NPSR1
SCHEMBL2881671 0.83 LMNA (0.40) MCHR1LMNAGAANPSR1ALDH1A1
SCHEMBL2881669 0.83 LMNA (0.40) MCHR1LMNAGAANPSR1ALDH1A1
SCHEMBL2881734 0.76 MCHR1 (0.67) MCHR1KCNH2LMNAHDAC1HDAC2
SCHEMBL2881733 0.76 MCHR1 (0.67) MCHR1KCNH2LMNAHDAC1HDAC2
SCHEMBL2876593 0.72 MCHR1 (0.53) MCHR1
SCHEMBL2879466 0.70 MCHR1 (0.56) MCHR1KCNH2HTR2A

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 4/4885KCNH2 2487/4885LMNA 1449/4885

“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.