SCHEMBL4145248

SCHEMBL4145248

c1ccc(-c2ccc3c(c2)CCC(N2CCCC2)C3)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 0.51
FAAH O00519 3/20 0.46
HTR1A P08908 1/20 0.45
HTR7 P34969 1/20 0.45
HTR1D P28221 2/20 0.43
OPRM1 P35372 2/20 0.42
OPRK1 P41145 2/20 0.42
OPRL1 P41146 2/20 0.42
BACE1 P56817 1/20 0.42
OPRD1 P41143 1/20 0.42
TSHR P16473 1/20 0.42
CTSD P07339 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41

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
SCHEMBL4133564 0.90 HTR1A (0.48) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4135988 0.87 HTR1A (0.49) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4148545 0.87 HTR1A (0.44) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4136629 0.87 OPRM1 (0.44) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4141143 0.87 OPRM1 (0.44) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4132535 0.87 OPRM1 (0.44) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4147479 0.87 FYN (0.44) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4136458 0.86 HRH3 (0.45) GRIN2BFAAHHTR1AHTR7HTR1D
SCHEMBL4139998 0.86 HRH3 (0.45) GRIN2BHTR1AHTR7HTR1DOPRM1
SCHEMBL4141125 0.86 HTR1A (0.47) GRIN2BHTR1AHTR7HTR1DCYP11B1

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 GRIN2B 86/4885FAAH 217/4885HTR1A 19/4885

“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.