SCHEMBL3470083

SCHEMBL3470083

Cc1ccccc1C1CCN(S(=O)(=O)c2cccc(N3CCN(C)CC3)n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 12/20 0.46
HTR3E A5X5Y0 3/20 0.44
HTR3B O95264 3/20 0.44
HTR3A P46098 3/20 0.44
HTR3D Q70Z44 3/20 0.44
HTR3C Q8WXA8 3/20 0.44
HTR6 P50406 2/20 0.41
HTR2A P28223 1/20 0.41
HTR2B P41595 1/20 0.41
THRB P10828 1/20 0.40
KMT2A Q03164 1/20 0.40

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 SCHEMBL3466939 0.99 HSD11B1 (0.45) HSD11B1HTR3EHTR3BHTR3AHTR3D
SCHEMBL4295305 0.88 HSD11B1 (0.45) HSD11B1HTR3EHTR3BHTR3AHTR3D
SCHEMBL3468056 0.81 HSD11B1 (0.49) HSD11B1
SCHEMBL3469534 0.75 HSD11B1 (0.44) HSD11B1HTR3EHTR3BHTR3AHTR3D
Hydrochloric Acid SCHEMBL3469891 0.74 HSD11B1 (0.43) HSD11B1HTR3EHTR3BHTR3AHTR3D
SCHEMBL4297498 0.74 GPR119 (0.46) THRB
SCHEMBL4290539 0.71 HSD11B1 (0.43) HSD11B1HTR3EHTR3BHTR3AHTR3D
SCHEMBL13085385 0.71 HTR2C (0.58) HTR6HTR2A
SCHEMBL4300878 0.70 PROKR1 (0.46) HSD11B1HTR3EHTR3BHTR3AHTR3D
SCHEMBL2962518 0.69 FAAH (0.53) HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2265600-A1 PYRIDINYL AMIDES FOR THE TREATMENT OF CNS AND METABOLIC DISORDERS Pfizer Inc. (US) 2010-12-29 EP disclosed
WO-2009098576-A1 PYRIDINYL AMIDES FOR THE TREATMENT OF CNS AND METABOLIC DISORDERS PFIZER INC. (US) 2009-08-13 WO disclosed
WO-2009098576-A1 PYRIDINYL AMIDES FOR THE TREATMENT OF CNS AND METABOLIC DISORDERS PFIZER INC. (US) 2009-08-13 WO disclosed
US-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders PFIZER INC. 2009-08-06 US disclosed
US-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders PFIZER INC. 2009-08-06 US disclosed
US-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders PFIZER INC. 2009-08-06 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-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders HTR6, HTR5A, TPH1 HSD11B1 1704/4885HTR3E 26/4885HTR3B 12/4885

“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.