SCHEMBL23051965

SCHEMBL23051965

COC(=O)[C@@H](NC(=O)c1cnc(-c2cccc(-c3cc(C(=O)NC(C4CC4)C4CC4)n(CC(C)(C)O)n3)c2)o1)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.34
▸ CNR1 P21554 2/20 0.34
▸ POLB P06746 2/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ TACR3 P29371 1/20 0.33
▸ MME P08473 1/20 0.32
▸ MMP13 P45452 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ USP30 Q70CQ3 1/20 0.31
▸ PHGDH O43175 1/20 0.31

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
SCHEMBL28721016 1.00 CNR2 (0.34) CNR2CNR1POLBABCG2TACR3
SCHEMBL23051963 0.94 FAAH (0.34) CNR2CNR1POLBMMEHSP90AA1
SCHEMBL23051947 0.94 FAAH (0.34) CNR2CNR1POLBMMEHSP90AA1
SCHEMBL23041388 0.93 MME (0.36) MMEUSP30PHGDH
SCHEMBL23041498 0.93 MME (0.36) MMEUSP30PHGDH
SCHEMBL23041497 0.93 MME (0.36) MMEUSP30PHGDH
SCHEMBL23041387 0.93 MME (0.36) MMEUSP30PHGDH
SCHEMBL23051964 0.90 MME (0.34) MMEMMP13USP30PHGDH
SCHEMBL23052228 0.90 PHGDH (0.34) CNR2CNR1POLBABCG2TACR3
SCHEMBL28722775 0.90 PHGDH (0.34) CNR2CNR1POLBABCG2TACR3

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-20220306617-A1 SUBSTITUTED 1,3-PHENYL HETEROARYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2022-09-29 — — US 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 claimed
US-20220306617-A1 SUBSTITUTED 1,3-PHENYL HETEROARYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2022-09-29 — — US disclosed
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

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-20220306617-A1 SUBSTITUTED 1,3-PHENYL HETEROARYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE CFTR, TMEM161A, TMEM164 CNR2 1166/4885CNR1 623/4885POLB 4320/4885

“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.

Send feedback