SCHEMBL4149013

SCHEMBL4149013

CCOC(=O)c1ccc(-c2ccc3c(c2)CCC(N2CCCC2C)C3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 2/20 0.44
DRD2 P14416 1/20 0.44
FDFT1 P37268 1/20 0.43
ALDH1A1 P00352 4/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP19A1 P11511 2/20 0.40
HRH3 Q9Y5N1 4/20 0.40
KCNH2 Q12809 2/20 0.40
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL4130658 0.91 ALOX5 (0.42) DRD3MAPK1HRH3
SCHEMBL4142054 0.88 HRH3 (0.49) DRD3ALDH1A1HRH3MAPTHPGD
SCHEMBL4140986 0.86 PDCD1 (0.41) ALDH1A1HRH3KCNH2MEN1KMT2A
SCHEMBL4143078 0.84 PDE4A (0.41) DRD3HRH3KCNH2HPGDHTR1A
SCHEMBL4140221 0.83 MCHR1 (0.38) HRH3KCNH2
SCHEMBL4136724 0.82 HTR2A (0.39) ALDH1A1HRH3KCNH2KDM4EMEN1
SCHEMBL4140206 0.81 HRH3 (0.40) ALDH1A1HRH3KCNH2KMT2ANPSR1
SCHEMBL4136847 0.81 HRH3 (0.39) DRD2HRH3KCNH2HTR1A
SCHEMBL4147612 0.80 HRH3 (0.43) HRH3KCNH2
SCHEMBL4142343 0.79 HRH3 (0.40) HRH3KCNH2

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 DRD3 167/4885DRD2 197/4885FDFT1 2928/4885

“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.