SCHEMBL18239707

SCHEMBL18239707

CNC(=O)NCCc1c(C)n(S(=O)(=O)c2ccc(C)cc2)c2ccc(O)cc12

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.51
SPR P35270 1/20 0.46
PTGDR Q13258 4/20 0.42
MAPT P10636 4/20 0.42
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR6 P50406 1/20 0.40
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
KDM4E B2RXH2 2/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
AGTR1 P30556 2/20 0.37
GAA P10253 1/20 0.36

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
SCHEMBL18222559 0.90 PTGDR2 (0.53) PTGDR2SPRPTGDRMAPTPOLB
SCHEMBL18222512 0.88 PTGDR2 (0.51) PTGDR2SPRPTGDRMAPTPOLB
SCHEMBL18239786 0.87 HTR6 (0.56) PTGDR2PTGDRMAPTPOLBHTR6
SCHEMBL28100912 0.80 SPR (0.45) PTGDR2SPRPTGDRMAPTHTR6
SCHEMBL18239836 0.79 HTR6 (0.43) PTGDR2PTGDRMAPTPOLBMEN1
SCHEMBL28100773 0.79 SPR (0.48) PTGDR2SPRPTGDRMAPTHTR6
SCHEMBL18239791 0.78 PTGDR2 (0.40) PTGDR2PTGDRMAPTPOLBHTR6
SCHEMBL18239754 0.77 HTR6 (0.57) PTGDR2PTGDRPOLBHTR6KDM4E
SCHEMBL18800024 0.75 SPR (0.50) SPRMAPTKDM4EGAA
SCHEMBL18222517 0.75 HTR6 (0.56) PTGDR2PTGDRHTR6

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-9637451-B2 Indole compound ASTELLAS PHARMA INC. (JP) 2017-05-02 US disclosed
EP-3095781-A1 INDOLE COMPOUND Astellas Pharma Inc. (JP) 2016-11-23 EP disclosed
US-20160332966-A1 INDOLE COMPOUND ASTELLAS PHARMA INC. (JP) 2016-11-17 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-20160332966-A1 INDOLE COMPOUND MTNR1A, MTNR1B, IDO2 PTGDR2 86/4885SPR 698/4885PTGDR 205/4885

“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.