SCHEMBL5452920

SCHEMBL5452920

COc1cc2c(cc1NS(=O)(=O)c1ccc(CN(C)c3ccc(F)cc3)cc1)CCN(C)CC2

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 9/20 0.58
DRD2 P14416 8/20 0.58
DRD3 P35462 8/20 0.58
HTR6 P50406 8/20 0.58
HTR2A P28223 7/20 0.58
ALDH1A1 P00352 3/20 0.46
TRIM24 O15164 1/20 0.43
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
KMT2A Q03164 1/20 0.41
ABCB1 P08183 2/20 0.40
HTR2B P41595 1/20 0.40
LIMK2 P53671 1/20 0.39

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
SCHEMBL14580859 1.00 HTR2C (0.58) HTR2CDRD2DRD3HTR6HTR2A
Hydrochloric Acid SCHEMBL5438399 0.99 HTR2C (0.57) HTR2CDRD2DRD3HTR6HTR2A
SCHEMBL14580861 0.88 HTR2C (0.55) HTR2CDRD2DRD3HTR6HTR2A
SCHEMBL14580866 0.88 DRD2 (0.44) HTR2CDRD2DRD3HTR6HTR2A
SCHEMBL14580867 0.88 DRD2 (0.44) HTR2CDRD2DRD3HTR6HTR2A
SCHEMBL5443058 0.85 DRD2 (0.49) HTR2CDRD2DRD3HTR6HTR2A
Hydrochloric Acid SCHEMBL5443529 0.85 DRD2 (0.48) HTR2CDRD2DRD3HTR6HTR2A
SCHEMBL5445098 0.83 DRD2 (0.60) HTR2CDRD2DRD3HTR6HTR2A
SCHEMBL5435607 0.83 DRD2 (0.60) HTR2CDRD2DRD3HTR6HTR2A
Hydrochloric Acid SCHEMBL5443066 0.82 DRD2 (0.59) HTR2CDRD2DRD3HTR6HTR2A

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 HTR2C 30/4885DRD2 25/4885DRD3 9/4885

“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.