SCHEMBL4140216

SCHEMBL4140216

CC1CCCN1C1CCc2cc(-c3cccc(CO)c3)ccc2C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.46
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
CYP11B2 P19099 2/20 0.36
LRRK2 Q5S007 1/20 0.36
GRIA2 P42262 1/20 0.36
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
SYK P43405 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP11B1 P15538 1/20 0.35
GRIN2B Q13224 2/20 0.35
ASIC3 Q9UHC3 1/20 0.35
MAP4K1 Q92918 1/20 0.35
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL4147612 0.90 HRH3 (0.43) HRH3HTR2AHTR2CHTR2B
SCHEMBL4135773 0.85 CYP11B1 (0.37) HRH3CYP11B2CYP1A2CYP11B1ASIC3
SCHEMBL4129121 0.85 HRH3 (0.39) HRH3CYP11B2CYP1A2CYP11B1GRIN2B
SCHEMBL4142343 0.85 HRH3 (0.40) HRH3CYP11B2CYP1A2CYP11B1GRIN2B
SCHEMBL4141100 0.84 HRH3 (0.38) HRH3CYP11B2DRD2CYP1A2CYP11B1
SCHEMBL4132406 0.83 MCHR1 (0.37) HRH3CYP11B2CYP1A2CYP11B1ASIC3
SCHEMBL4139692 0.83 HRH3 (0.45) HRH3CYP11B2CHRNB4CHRNA3CHRNA7
SCHEMBL4140221 0.82 MCHR1 (0.38) HRH3
SCHEMBL4148990 0.82 HRH3 (0.36) HRH3HTR2AHTR2CCYP11B2CYP1A2
SCHEMBL4141225 0.82 HRH3 (0.49) HRH3HTR2CHTR2BDRD3GRIN2B

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 claimed

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 HRH3 1/4885HTR2A 26/4885HTR2C 9/4885

“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.