SCHEMBL17841289

SCHEMBL17841289

CCn1c(=O)cc(N[C@H](CC(=O)O)c2cccc(Cl)c2)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.43
▸ OGT O15294 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CTSA P10619 3/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2B6 P20813 1/20 0.40
▸ PNP P00491 2/20 0.38
▸ DCAF1 Q9Y4B6 1/20 0.38
▸ ITGB3 P05106 2/20 0.38
▸ ITGAV P06756 2/20 0.38
▸ ITGB6 P18564 2/20 0.38
▸ ROCK2 O75116 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37

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
SCHEMBL17857556 0.93 PGR (0.42) PGROGTHTTSMN1; SMN2CYP3A4
SCHEMBL18898417 0.91 PGR (0.39) PGROGTHTTSMN1; SMN2CYP3A4
SCHEMBL17861559 0.89 PGR (0.40) PGRROCK2ALDH1A1
SCHEMBL16322050 0.83 HTT (0.53) PGRHTTSMN1; SMN2CYP3A4CYP2B6
SCHEMBL16322048 0.83 HTT (0.53) PGRHTTSMN1; SMN2CYP3A4CYP2B6
SCHEMBL16321357 0.79 SMN1; SMN2 (0.50) HTTSMN1; SMN2CYP3A4CYP2B6ALDH1A1
SCHEMBL16321359 0.79 SMN1; SMN2 (0.50) HTTSMN1; SMN2CYP3A4CYP2B6ALDH1A1
SCHEMBL16364694 0.77 SMN1; SMN2 (0.50) HTTSMN1; SMN2CYP3A4CYP2B6
SCHEMBL16324040 0.75 SMN1; SMN2 (0.69) HTTSMN1; SMN2CYP3A4CYP2B6ALDH1A1
SCHEMBL16324039 0.75 SMN1; SMN2 (0.69) HTTSMN1; SMN2CYP3A4CYP2B6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663516-B2 Bicyclic-pyrimidinedione compounds MyoKardia, Inc. (US) 2017-05-30 — — US disclosed
US-9663516-B2 Bicyclic-pyrimidinedione compounds MyoKardia, Inc. (US) 2017-05-30 — — US disclosed
US-9663516-B2 Bicyclic-pyrimidinedione compounds MyoKardia, Inc. (US) 2017-05-30 — — US disclosed
US-20160176868-A1 BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2016-06-23 — — US disclosed
US-20160176868-A1 BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2016-06-23 — — US disclosed
US-20160176868-A1 BICYCLIC-PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2016-06-23 — — 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-20160176868-A1 BICYCLIC-PYRIMIDINEDIONE COMPOUNDS TNNI3, NME4, TNNT2 PGR 1983/4885OGT 2978/4885HTT 268/4885

“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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