SCHEMBL4136102

SCHEMBL4136102

O=C(O)c1ccc(-c2ccc3c(c2)CCC(N2CCCC2)C3)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.44
MCHR1 Q99705 1/20 0.43
L3MBTL3 Q96JM7 6/20 0.42
ADRB3 P13945 7/20 0.41
ADRB1 P08588 3/20 0.41
TDP2 O95551 1/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 4/20 0.40
MBTD1 Q05BQ5 4/20 0.40
TP53BP1 Q12888 1/20 0.40
L3MBTL4 Q8NA19 1/20 0.40
KDM2B Q8NHM5 1/20 0.40
GRIN2B Q13224 1/20 0.40

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
SCHEMBL4133418 0.89 L3MBTL3 (0.51) FAAHMCHR1L3MBTL3ADRB3TDP2
SCHEMBL4132414 0.89 HRH3 (0.45) FAAHL3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL4135538 0.86 L3MBTL3 (0.53) L3MBTL3ALDH1A1L3MBTL1MBTD1TP53BP1
SCHEMBL4135754 0.86 HRH3 (0.42) FAAHL3MBTL3ALDH1A1KDM2B
SCHEMBL4132197 0.85 HRH3 (0.53) FAAHMCHR1L3MBTL3L3MBTL1
SCHEMBL4143084 0.85 KCNH2 (0.47) MCHR1L3MBTL3ALDH1A1L3MBTL1KDM2B
SCHEMBL4145248 0.85 GRIN2B (0.51) FAAHGRIN2B
SCHEMBL4147479 0.84 FYN (0.44) FAAHGRIN2B
SCHEMBL4144854 0.83 HRH3 (0.52) ALDH1A1
SCHEMBL4141827 0.83 HRH3 (0.49) FAAHMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 FAAH 217/4885MCHR1 287/4885L3MBTL3 3062/4885

“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.