SCHEMBL4136275

SCHEMBL4136275

CS(=O)(=O)c1cccc(-c2ccc3c(c2)CCC(N2CCC(c4ccccc4)C2)C3)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 4/20 0.49
DRD2 P14416 3/20 0.43
DRD3 P35462 4/20 0.40
SIGMAR1 Q99720 1/20 0.40
NR1H2 P55055 3/20 0.38
NR1H3 Q13133 3/20 0.38
RXRA P19793 1/20 0.38
HTR6 P50406 2/20 0.37
MCOLN2 Q8IZK6 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
MCOLN1 Q9GZU1 1/20 0.37
GRIA2 P42262 1/20 0.37
KDM2B Q8NHM5 1/20 0.36
BCL9 O00512 1/20 0.36
CTNNB1 P35222 1/20 0.36
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
FAAH O00519 1/20 0.35

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
SCHEMBL4130398 0.83 ACVR1 (0.39) GRIN2BDRD2DRD3NR1H2NR1H3
SCHEMBL4141043 0.81 KDM2B (0.38) DRD2DRD3NR1H2NR1H3RXRA
SCHEMBL4152780 0.81 JAK2 (0.47) GRIN2BGRIA2
SCHEMBL4776492 0.80 GRIN2B (0.49) GRIN2BDPP4DPP8FAAH
SCHEMBL4127903 0.79 GRIA2 (0.40) GRIN2BNR1H2GRIA2KDM2BDPP4
SCHEMBL4149135 0.76 GRIN2B (0.48) GRIN2BFAAH
SCHEMBL4136207 0.75 USP30 (0.42) DRD3KDM2B
SCHEMBL4140906 0.73 USP30 (0.43) DRD3
SCHEMBL4142661 0.73 USP30 (0.43) DRD3
SCHEMBL4144821 0.73 USP30 (0.43) DRD3

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 GRIN2B 86/4885DRD2 197/4885DRD3 167/4885

“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.