SCHEMBL18239784

SCHEMBL18239784

CNC(=O)NCCc1cn(S(=O)(=O)c2ccc(C)cc2)c2cc(F)c(O)cc12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.45
ALK Q9UM73 1/20 0.43
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
PPARG P37231 3/20 0.39
PPARD Q03181 3/20 0.39
PPARA Q07869 3/20 0.39
IDE P14735 2/20 0.39
ALOX5 P09917 2/20 0.38
PTGS2 P35354 1/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 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
SCHEMBL18222546 0.90 HTR6 (0.47) HTR6ALKPDE4APDE4BPDE4C
SCHEMBL18239785 0.88 HTR6 (0.48) HTR6ALKPPARGPPARDPPARA
SCHEMBL28100864 0.80 MTNR1A (0.44) HTR6PPARGPPARDPPARA
SCHEMBL18239764 0.79 SMN1; SMN2 (0.38) HTR6ALKPDE4APDE4BPDE4C
SCHEMBL18222527 0.78 HTR6 (0.50) HTR6PPARGPPARDPPARA
SCHEMBL3012635 0.75 HTR6 (0.55) HTR6ALKPPARGPPARDPPARA
SCHEMBL18222505 0.75 HTR6 (0.43) HTR6ALKPPARGPPARDPPARA
SCHEMBL18800001 0.74 MTNR1A (0.38)
SCHEMBL14605614 0.74 PPARG (0.61) HTR6ALKPDE4APDE4BPDE4C
SCHEMBL18239683 0.73 MTNR1A (0.43) HTR6ALKPDE4APDE4BPDE4C

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 HTR6 129/4885ALK 4144/4885PDE4A 1278/4885

“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.