SCHEMBL23041497

SCHEMBL23041497

CC(C)C(NC(=O)c1cc(-c2cccc(-c3ncc(C(=O)NC(C4CC4)C4CC4)o3)c2)nn1CC(C)(C)O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.36
▸ DGAT1 O75907 2/20 0.34
▸ USP30 Q70CQ3 1/20 0.33
▸ PHGDH O43175 2/20 0.33
▸ MMEL1 Q495T6 1/20 0.33
▸ PIN1 Q13526 5/20 0.32
▸ CSGALNACT1 Q8TDX6 3/20 0.32
▸ GPR132 Q9UNW8 2/20 0.32

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
SCHEMBL23041388 1.00 MME (0.36) MMEDGAT1USP30PHGDHMMEL1
SCHEMBL23041387 1.00 MME (0.36) MMEDGAT1USP30PHGDHMMEL1
SCHEMBL23041498 1.00 MME (0.36) MMEDGAT1USP30PHGDHMMEL1
SCHEMBL28721016 0.93 CNR2 (0.34) MMEUSP30PHGDH
SCHEMBL23051965 0.93 CNR2 (0.34) MMEUSP30PHGDH
SCHEMBL23051964 0.92 MME (0.34) MMEUSP30PHGDHMMEL1PIN1
SCHEMBL23051947 0.92 FAAH (0.34) MMEPHGDHMMEL1
SCHEMBL23051963 0.92 FAAH (0.34) MMEPHGDHMMEL1
SCHEMBL23041607 0.91 MME (0.37) MMEUSP30PHGDHMMEL1
SCHEMBL29707782 0.91 MME (0.37) MMEUSP30PHGDHMMEL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4021572-A1 SUBSTITUTED 1,3-PHENYL HETEROARYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE Novartis AG (CH) 2022-07-06 — — EP claimed
WO-2021038426-A1 SUBSTITUTED 1,3-PHENYL HETEROARYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2021-03-04 — — WO claimed
EP-4021572-A1 SUBSTITUTED 1,3-PHENYL HETEROARYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE Novartis AG (CH) 2022-07-06 — — EP disclosed
CN-114341132-A Substituted 1, 3-phenylheteroaryl derivatives and their use in the treatment of diseases 诺华股份有限公司 2022-04-12 — — CN disclosed
WO-2021038426-A1 SUBSTITUTED 1,3-PHENYL HETEROARYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2021-03-04 — — WO disclosed
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