SCHEMBL16320771

SCHEMBL16320771

CC[C@H](Nc1cc(=O)n(C(C)C)c(=O)[nH]1)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.72
▸ CYP2B6 P20813 1/20 0.72
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ HTT P42858 1/20 0.52
▸ POLB P06746 2/20 0.38
▸ DUT P33316 2/20 0.38
▸ TP53 P04637 1/20 0.37
▸ BRD4 O60885 1/20 0.36
▸ ATP1A1 P05023 1/20 0.36
▸ ATP1B1 P05026 1/20 0.36
▸ ATP1A3 P13637 1/20 0.36
▸ ATP1B2 P14415 1/20 0.36
▸ ATP1A2 P50993 1/20 0.36
▸ ATP1B3 P54709 1/20 0.36
▸ FXYD2 P54710 1/20 0.36
▸ ATP1A4 Q13733 1/20 0.36
▸ CDK1 P06493 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ASPH Q12797 1/20 0.35
▸ KDM8 Q8N371 1/20 0.35

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
SCHEMBL16320772 1.00 CYP3A4 (0.72) CYP3A4CYP2B6SMN1; SMN2HTTPOLB
SCHEMBL16320781 0.90 CYP3A4 (0.69) CYP3A4CYP2B6SMN1; SMN2HTTPOLB
SCHEMBL16320779 0.90 CYP3A4 (0.69) CYP3A4CYP2B6SMN1; SMN2HTTPOLB
SCHEMBL16322092 0.89 CYP3A4 (0.70) CYP3A4CYP2B6SMN1; SMN2HTTPOLB
SCHEMBL16322089 0.89 CYP3A4 (0.70) CYP3A4CYP2B6SMN1; SMN2HTTPOLB
SCHEMBL16322062 0.88 CYP3A4 (0.56) CYP3A4CYP2B6SMN1; SMN2HTTDUT
SCHEMBL16322063 0.88 CYP3A4 (0.56) CYP3A4CYP2B6SMN1; SMN2HTTDUT
SCHEMBL17841303 0.88 CYP3A4 (0.69) CYP3A4CYP2B6SMN1; SMN2HTTPOLB
SCHEMBL17841304 0.88 CYP3A4 (0.69) CYP3A4CYP2B6SMN1; SMN2HTTPOLB
SCHEMBL16356127 0.86 CYP3A4 (0.67) CYP3A4CYP2B6SMN1; SMN2HTTPOLB

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4744664-A2 PYRIMIDINEDIONE COMPOUNDS AGAINST CARDIAC CONDITIONS MyoKardia, Inc. (US) 2026-05-20 — — EP disclosed
US-20240382486-A1 PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2024-11-21 — — US disclosed
US-RE50050-E1 Pyrimidinedione compounds MyoKardia, Inc. (US) 2024-07-23 — — US disclosed
US-20230338378-A1 Methods of Administering Myosin Inhibitors MyoKardia, Inc. 2023-10-26 — — US disclosed
CN-109384729-B Pyrimidinedione compounds for cardiac disorders 迈奥卡迪亚公司 2023-06-30 — — CN disclosed
US-20230165860-A1 PYRIMIDINEDIONE COMPOUNDS MYOKARDIA INC (US) 2023-06-01 — — US disclosed
US-20230165860-A1 PYRIMIDINEDIONE COMPOUNDS MYOKARDIA INC (US) 2023-06-01 — — US disclosed
US-20230165860-A1 PYRIMIDINEDIONE COMPOUNDS MYOKARDIA INC (US) 2023-06-01 — — US disclosed
US-20230158027-A1 METHODS OF TREATMENT WITH MYOSIN MODULATOR MyoKardia, Inc. 2023-05-25 — — US disclosed
US-20230158027-A1 METHODS OF TREATMENT WITH MYOSIN MODULATOR MyoKardia, Inc. 2023-05-25 — — US disclosed
US-20160030428-A1 PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2016-02-04 — — US disclosed
US-20160030428-A1 PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2016-02-04 — — US disclosed
US-9181200-B2 Pyrimidinedione compounds MyoKardia, Inc. (US) 2015-11-10 — — US disclosed
US-9181200-B2 Pyrimidinedione compounds MyoKardia, Inc. (US) 2015-11-10 — — US disclosed
US-9181200-B2 Pyrimidinedione compounds MyoKardia, Inc. (US) 2015-11-10 — — US disclosed
US-20140378464-A1 PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2014-12-25 — — US disclosed
US-20140378464-A1 PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2014-12-25 — — US disclosed
US-20140378464-A1 PYRIMIDINEDIONE COMPOUNDS MyoKardia, Inc. 2014-12-25 — — US disclosed
WO-2014205223-A1 PYRIMIDINEDIONE COMPOUNDS AGAINST CARDIAC CONDITIONS MyoKardia, Inc. (US) 2014-12-24 — — WO disclosed
WO-2014205223-A1 PYRIMIDINEDIONE COMPOUNDS AGAINST CARDIAC CONDITIONS MyoKardia, Inc. (US) 2014-12-24 — — WO 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 (6 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-20230158027-A1 METHODS OF TREATMENT WITH MYOSIN MODULATOR MYH10, MYH2, MYH14 CYP3A4 4368/4885CYP2B6 4778/4885SMN1; SMN2 134/4885
US-20140378464-A1 PYRIMIDINEDIONE COMPOUNDS TYMS, TYMP, DPYD CYP3A4 2600/4885CYP2B6 1992/4885SMN1; SMN2 1177/4885
US-20240382486-A1 PYRIMIDINEDIONE COMPOUNDS TYMS, TYMP, DPYD CYP3A4 2600/4885CYP2B6 1992/4885SMN1; SMN2 1177/4885
US-20160030428-A1 PYRIMIDINEDIONE COMPOUNDS TYMS, TYMP, DPYD CYP3A4 2600/4885CYP2B6 1992/4885SMN1; SMN2 1177/4885
US-20230338378-A1 Methods of Administering Myosin Inhibitors MYH2, MYLK2, MYH10 CYP3A4 3078/4885CYP2B6 3439/4885SMN1; SMN2 283/4885
US-20230165860-A1 PYRIMIDINEDIONE COMPOUNDS TYMS, TYMP, DPYD CYP3A4 2600/4885CYP2B6 1992/4885SMN1; SMN2 1177/4885

“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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