SCHEMBL4142137

SCHEMBL4142137

COC(C)c1ccc(-c2ccc3c(c2)CCC(N2CCCC2C)C3)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.35
KCNH2 Q12809 2/20 0.35
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
CYP2B6 P20813 1/20 0.33
ADRB3 P13945 2/20 0.32
ASIC3 Q9UHC3 1/20 0.31
CHRM2 P08172 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
AKR1C2 P52895 1/20 0.30
AKR1C1 Q04828 1/20 0.30
MCHR1 Q99705 1/20 0.30

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
SCHEMBL4128761 0.89 HRH3 (0.38) HRH3KCNH2ADRB3ASIC3MCHR1
SCHEMBL4128730 0.84 OPRM1 (0.40) HRH3KCNH2CYP11B2ALDH1A1MCHR1
SCHEMBL4143141 0.84 OPRM1 (0.40) HRH3KCNH2CYP11B2ALDH1A1MCHR1
SCHEMBL4143136 0.84 OPRM1 (0.40) HRH3KCNH2CYP11B2ALDH1A1MCHR1
SCHEMBL4128728 0.84 OPRM1 (0.40) HRH3KCNH2CYP11B2ALDH1A1MCHR1
SCHEMBL4128725 0.84 OPRM1 (0.40) HRH3KCNH2CYP11B2ALDH1A1MCHR1
SCHEMBL4133534 0.84 HTR1D (0.37) CYP1A2CYP3A4CYP2C9CYP11B1CYP11B2
SCHEMBL4152815 0.83 GRIN2D (0.36) HRH3KCNH2CYP1A2CYP3A4CYP2C9
SCHEMBL4140206 0.83 HRH3 (0.40) HRH3KCNH2CYP1A2CYP3A4CYP2C9
SCHEMBL4142343 0.83 HRH3 (0.40) HRH3KCNH2CYP1A2CYP3A4CYP2C9

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 3 patents. 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
EP-2007749-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR Pfizer Products Inc. (US) 2008-12-31 EP claimed
WO-2007105053-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR PFIZER PRODUCTS INC. (US) 2007-09-20 WO 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 1/4885KCNH2 657/4885CYP1A2 1220/4885

“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.