SCHEMBL1950696

SCHEMBL1950696

COCCC(=O)N1CCc2ccc(N(Cc3ccc(Cl)cc3)S(=O)(=O)c3ccn(C)n3)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.39
DRD4 P21917 8/20 0.39
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.34
NOTUM Q6P988 1/20 0.34
THRB P10828 2/20 0.34
TP53 P04637 1/20 0.34
MEN1 O00255 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL1950714 0.94 DRD2 (0.42) DRD2DRD4ALDH1A1GAATSHR
SCHEMBL1947007 0.92 DRD2 (0.40) DRD2DRD4ALDH1A1GAATSHR
SCHEMBL1949371 0.88 NOTUM (0.47) DRD2DRD4ALDH1A1GAAMAPT
SCHEMBL1951261 0.87 DRD2 (0.38) DRD2DRD4ALDH1A1GAATSHR
SCHEMBL1948520 0.86 ALDH1A1 (0.36) DRD2DRD4ALDH1A1GAATSHR
SCHEMBL1950166 0.86 PTPN11 (0.43) DRD2DRD4ALDH1A1GAATSHR
SCHEMBL2641573 0.85 NOTUM (0.44) DRD2DRD4ALDH1A1GAAMAPT
SCHEMBL1950702 0.81 NOTUM (0.47) DRD2DRD4ALDH1A1GAATSHR
SCHEMBL1949755 0.81 DRD4 (0.43) DRD2DRD4ALDH1A1GAATSHR
SCHEMBL1951599 0.79 DRD2 (0.40) DRD2DRD4ALDH1A1GAANOTUM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136860-A1 Compounds XENTION LTD. (GB) 2011-06-09 US claimed
US-20110136860-A1 Compounds XENTION LTD. (GB) 2011-06-09 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-20110136860-A1 Compounds NR3C2, NR5A1, NR0B2 DRD2 385/4885DRD4 739/4885ALDH1A1 1879/4885

“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.