SCHEMBL5437461

SCHEMBL5437461

CN1CCc2cc(NS(=O)(=O)c3ccc(OCc4ccc(F)cc4)cc3)c(N(C)C)cc2CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.48
HRH3 Q9Y5N1 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
DRD2 P14416 8/20 0.44
HTR2C P28335 8/20 0.44
DRD3 P35462 8/20 0.44
HTR6 P50406 8/20 0.44
HTR2A P28223 7/20 0.44
MMP1 P03956 2/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP14 P50281 1/20 0.44
ADAM17 P78536 1/20 0.44
ADAM33 Q9BZ11 1/20 0.42
CACNA1H O95180 2/20 0.42
CACNA1B Q00975 2/20 0.42

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
Hydrochloric Acid SCHEMBL5439381 0.99 AR (0.47) ARHRH3CA12CA1CA2
SCHEMBL3899180 0.84 HRH3 (0.46) ARHRH3CA12CA1CA2
SCHEMBL14580867 0.83 DRD2 (0.44) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL14580866 0.83 DRD2 (0.44) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5438401 0.77 DRD2 (0.60) ARHRH3CA12CA1CA2
SCHEMBL5445023 0.77 PTGDR2 (0.40) DRD2HTR2CDRD3HTR6HTR2A
Hydrochloric Acid SCHEMBL5441611 0.77 DRD2 (0.59) ARHRH3CA12CA1CA2
Hydrochloric Acid SCHEMBL5443092 0.76 PTGDR2 (0.39) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5452920 0.74 HTR2C (0.58) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL14580859 0.74 HTR2C (0.58) DRD2HTR2CDRD3HTR6HTR2A

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-20070043026-A1 Dopamine receptor modulators as antipsychotic agents GLAXO GROUP LIMITED (GB) 2007-02-22 US claimed
US-20070043026-A1 Dopamine receptor modulators as antipsychotic agents GLAXO GROUP LIMITED (GB) 2007-02-22 US disclosed
US-20070043026-A1 Dopamine receptor modulators as antipsychotic agents GLAXO GROUP LIMITED (GB) 2007-02-22 US disclosed

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-20070043026-A1 Dopamine receptor modulators as antipsychotic agents SIGMAR1, CHRM1, OPRM1 AR 217/4885HRH3 141/4885CA12 2512/4885

“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.