SCHEMBL17434593

SCHEMBL17434593

CCn1c(=O)c2cc(NC(=O)CC(C)N)ccc2n(CC)c1=O

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 10/20 0.64
▸ KDM4E B2RXH2 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MAPT P10636 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ NPY5R Q15761 4/20 0.47
▸ MDM2 Q00987 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL17434545 0.91 RORC (0.62) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434546 0.91 RORC (0.62) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434493 0.89 RORC (0.68) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434241 0.88 RORC (0.67) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434508 0.87 RORC (0.69) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434402 0.87 RORC (0.60) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434030 0.86 RORC (0.71) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434295 0.85 RORC (0.61) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL16092755 0.84 RORC (0.66) RORCKDM4ESMN1; SMN2MAPTLMNA
SCHEMBL17434559 0.84 RORC (0.59) RORCKDM4ESMN1; SMN2MAPTLMNA

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-9834520-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-12-05 — — US disclosed
US-20160229814-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-11 — — US disclosed
EP-2975031-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2016-01-20 — — 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-20160229814-A1 HETEROCYCLIC COMPOUND RORB, RORC, RORA RORC 2/4885KDM4E 728/4885SMN1; SMN2 4706/4885

“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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