SCHEMBL5705019

SCHEMBL5705019

CS(=O)(=O)c1ccc(Cn2cc(C3CCN(C(=O)O)CC3)c3ccccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.49
SLC2A1 P11166 1/20 0.49
HTR6 P50406 3/20 0.48
DRD2 P14416 1/20 0.48
HRH2 P25021 3/20 0.47
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
NCOR2 Q9Y618 1/20 0.46
HTR2A P28223 3/20 0.46
HTR2C P28335 3/20 0.46
HTR2B P41595 3/20 0.46
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
SMO Q99835 1/20 0.45
SLC5A1 P13866 2/20 0.45

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
SCHEMBL6133467 0.87 GPR119 (0.54) SLC2A1HDAC3HDAC1HDAC2HDAC10
Hydrochloric Acid SCHEMBL6133627 0.82 HTR6 (0.53) PTGDR2HTR6DRD2HDAC3HDAC1
SCHEMBL5705109 0.78 HTR6 (0.50) SLC2A1HTR6DRD2HRH2HDAC3
SCHEMBL5705118 0.77 SLC2A1 (0.56) SLC2A1HTR6DRD2HRH2HDAC3
SCHEMBL27494197 0.77 ALDH1A1 (0.59) SLC2A1HTR6DRD2HRH2MEN1
SCHEMBL3429738 0.76 CHRM1 (0.65) PTGDR2MEN1MAPTKMT2ACHRM1
SCHEMBL14084478 0.74 HTR2A (0.55) SLC2A1HTR6DRD2HRH2HTR2A
SCHEMBL5705162 0.74 RORC (0.51) MEN1KMT2A
SCHEMBL5344670 0.73 ALDH1A1 (0.49) SLC2A1HTR6DRD2HRH2HTR2A
SCHEMBL5705160 0.72 SLC2A1 (0.52) SLC2A1HTR6DRD2HRH2HDAC3

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
EP-1691807-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF BONE DISEASES Astellas Pharma Inc. (JP) 2006-08-23 EP disclosed
US-20050245540-A1 New methods FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
WO-2005056012-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF BONE DISEASES ASTELLAS PHARMA INC. (JP) 2005-06-23 WO 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-20050245540-A1 New methods TGFB1, TGFBR1, TGFB2 PTGDR2 451/4885SLC2A1 1374/4885HTR6 1013/4885

“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.