SCHEMBL4136422

SCHEMBL4136422

Cc1ccc(-c2ccc3c(c2)CCC(N2CCCC2)C3)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.41
HTR7 P34969 1/20 0.41
GRIN2B Q13224 2/20 0.40
HTR1D P28221 2/20 0.39
OPRL1 P41146 5/20 0.38
OPRM1 P35372 3/20 0.38
OPRK1 P41145 3/20 0.38
FAAH O00519 1/20 0.38
LMNA P02545 1/20 0.36
OPRD1 P41143 1/20 0.35
TSHR P16473 1/20 0.34
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34
PRKDC P78527 1/20 0.34
KCNJ1 P48048 1/20 0.33

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
SCHEMBL4147604 0.84 HTR1A (0.47) HTR1AHTR7GRIN2BHTR1DOPRL1
SCHEMBL4141272 0.84 HRH3 (0.33) GRIN2BLMNAPRKDC
SCHEMBL4148484 0.83 LMNA (0.40) HTR1AHTR7GRIN2BHTR1DOPRL1
SCHEMBL4137087 0.82 HTR1D (0.41) HTR1AHTR7GRIN2BHTR1DOPRL1
SCHEMBL4133564 0.81 HTR1A (0.48) HTR1AHTR7GRIN2BHTR1DOPRL1
SCHEMBL4141070 0.81 HTR1A (0.41) HTR1AHTR7GRIN2BHTR1DOPRL1
SCHEMBL4142789 0.80 HTR7 (0.41) HTR1AHTR7GRIN2BHTR1DOPRL1
SCHEMBL4664249 0.80 FYN (0.41) HTR1AHTR7GRIN2BHTR1DOPRL1
SCHEMBL4136905 0.80 HTR7 (0.44) HTR1AHTR7GRIN2B
SCHEMBL4145248 0.79 GRIN2B (0.51) HTR1AHTR7GRIN2BHTR1DOPRL1

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 HTR1A 19/4885HTR7 7/4885GRIN2B 86/4885

“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.