SCHEMBL18239708

SCHEMBL18239708

CC(=O)NCCc1c(C)n(S(=O)(=O)c2ccc(C)cc2)c2cc(F)c(OCCn3ccc(C)n3)cc12

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.40
PTGDR Q13258 3/20 0.35
MAPT P10636 2/20 0.34
APOL1 O14791 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
PLA2G4A P47712 1/20 0.33
NQO2 P16083 2/20 0.33
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
GFER P55789 1/20 0.32

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
SCHEMBL18239689 0.88 PTGDR2 (0.41) PTGDR2PTGDRMAPTPLA2G4ANQO2
SCHEMBL18239839 0.87 PTGDR2 (0.40) PTGDR2PTGDRMAPTKMT2AMEN1
SCHEMBL18239709 0.86 PTGDR2 (0.44) PTGDR2PTGDRMAPTKMT2AMEN1
SCHEMBL18239866 0.85 PTGDR2 (0.43) PTGDR2PTGDRMAPTKMT2AMEN1
SCHEMBL18239765 0.83 PTGDR2 (0.48) PTGDR2PTGDRMAPTNQO2MTNR1A
SCHEMBL18239803 0.82 PTGDR2 (0.41) PTGDR2PTGDRMAPTNQO2MTNR1A
SCHEMBL18800084 0.82 MTNR1A (0.36) APOL1PLA2G4ANQO2MTNR1AMTNR1B
SCHEMBL18239791 0.80 PTGDR2 (0.40) PTGDR2PTGDRMAPTPLA2G4AMTNR1A
SCHEMBL18222509 0.80 PTGDR2 (0.40) PTGDR2PTGDRMAPTPLA2G4AMTNR1A
SCHEMBL18239705 0.79 PTGDR2 (0.50) PTGDR2PTGDRMAPTKMT2AMEN1

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 86/4885PTGDR 205/4885MAPT 887/4885

“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.