SCHEMBL23041445

SCHEMBL23041445

CC(NC(=O)c1cnc(-c2cccc(-c3cc(C(=O)NC(C)C4CC4)n(CC(C)(C)O)n3)c2)o1)C1CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PHGDH O43175 2/20 0.35
▸ MME P08473 1/20 0.35
▸ USP30 Q70CQ3 1/20 0.35
▸ PIN1 Q13526 3/20 0.34
▸ RIPK1 Q13546 1/20 0.33
▸ KCNK3 O14649 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MET P08581 1/20 0.33
▸ IRAK4 Q9NWZ3 1/20 0.33
▸ ALPL P05186 1/20 0.33
▸ MMEL1 Q495T6 1/20 0.33

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
SCHEMBL23041442 1.00 PHGDH (0.35) PHGDHMMEUSP30PIN1RIPK1
SCHEMBL29452394 0.95 MME (0.35) PHGDHMMEUSP30PIN1KCNK3
SCHEMBL23041685 0.95 MME (0.35) PHGDHMMEUSP30PIN1KCNK3
SCHEMBL23041683 0.95 MME (0.35) PHGDHMMEUSP30PIN1KCNK3
SCHEMBL23051964 0.90 MME (0.34) PHGDHMMEUSP30PIN1MET
SCHEMBL29707782 0.89 MME (0.37) PHGDHMMEUSP30METALPL
SCHEMBL23041607 0.89 MME (0.37) PHGDHMMEUSP30METALPL
SCHEMBL23052257 0.88 PHGDH (0.39) PHGDHMMEUSP30PIN1RIPK1
SCHEMBL23041596 0.88 PHGDH (0.39) PHGDHMMEUSP30PIN1RIPK1
SCHEMBL23052261 0.88 PHGDH (0.39) PHGDHMMEUSP30PIN1RIPK1

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
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
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
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 PHGDH 3383/4885MME 4464/4885USP30 2666/4885

“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