SCHEMBL17434030

SCHEMBL17434030

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

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 12/20 0.71
▸ NPY5R Q15761 3/20 0.48
▸ KDM4E B2RXH2 4/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MAPT P10636 4/20 0.46
▸ LMNA P02545 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.45

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
SCHEMBL17434508 0.90 RORC (0.69) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL17434493 0.89 RORC (0.68) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL16092733 0.88 RORC (0.67) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL17434241 0.88 RORC (0.67) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL16092755 0.87 RORC (0.66) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL17434593 0.86 RORC (0.64) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL17434295 0.86 RORC (0.61) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL17434342 0.85 RORC (0.64) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL17434356 0.85 RORC (0.68) RORCNPY5RKDM4ESMN1; SMN2MAPT
SCHEMBL17434546 0.84 RORC (0.62) RORCNPY5RKDM4ESMN1; SMN2MAPT

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 2/4885NPY5R 210/4885KDM4E 728/4885

“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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