SCHEMBL15899198

SCHEMBL15899198

CCn1c2ccccc2c2cc(NC(=O)CC(C)CCO)ccc21

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 7/20 0.80
▸ MAPT P10636 7/20 0.67
▸ KDM4E B2RXH2 5/20 0.67
▸ LMNA P02545 2/20 0.67
▸ MEN1 O00255 1/20 0.67
▸ KMT2A Q03164 1/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.67
▸ NPY5R Q15761 5/20 0.64
▸ NPSR1 Q6W5P4 1/20 0.63
▸ ALDH1A1 P00352 2/20 0.61
▸ HPGD P15428 2/20 0.60
▸ GAA P10253 1/20 0.58

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
SCHEMBL15899190 0.88 RORC (0.89) RORCMAPTKDM4ELMNAMEN1
SCHEMBL19189749 0.87 RORC (0.87) RORCMAPTKDM4ELMNAMEN1
SCHEMBL29918544 0.84 RORC (1.00) RORCMAPTKDM4ELMNAMEN1
SCHEMBL14801913 0.84 RORC (1.00) RORCMAPTKDM4ELMNAMEN1
SCHEMBL17434241 0.83 RORC (0.67) RORCMAPTKDM4ELMNAMEN1
SCHEMBL14199692 0.82 MAPT (0.82) RORCMAPTKDM4ELMNAMEN1
SCHEMBL15899387 0.81 RORC (1.00) RORCMAPTKDM4ELMNAMEN1
SCHEMBL14822207 0.81 RORC (0.82) RORCMAPTKDM4ELMNAMEN1
SCHEMBL15899319 0.81 RORC (0.79) RORCMAPTKDM4ELMNAMEN1
SCHEMBL15899235 0.81 KDM4E (0.80) RORCMAPTKDM4ELMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2759533-B1 CONDENSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2017-08-02 — — EP disclosed
US-9120776-B2 Condensed heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-01 — — US disclosed
US-20140228409-A1 CONDENSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-14 — — US disclosed
EP-2759533-A1 CONDENSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-07-30 — — EP 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-20140228409-A1 CONDENSED HETEROCYCLIC COMPOUND RORC, RORB, RORA RORC 1/4885MAPT 2360/4885KDM4E 444/4885

“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.

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