SCHEMBL30006457

SCHEMBL30006457

CC(C)(C)OC(=O)N[C@H](CO)Cc1nc(-c2ccc(Oc3ccc(OC(F)F)cn3)cc2)no1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.45
▸ ACACB O00763 5/20 0.40
▸ KCNH2 Q12809 1/20 0.39
▸ SCN9A Q15858 3/20 0.36
▸ HDAC4 P56524 2/20 0.36
▸ HDAC6 Q9UBN7 2/20 0.36
▸ P2RX3 P56373 4/20 0.36
▸ PPARD Q03181 2/20 0.35
▸ PPARA Q07869 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MITF O75030 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ NCOA3 Q9Y6Q9 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
SCHEMBL30005383 0.92 LTA4H (0.38) LTA4HKCNH2SCN9AHDAC6
SCHEMBL24665373 0.92 LTA4H (0.38) LTA4HKCNH2SCN9AHDAC6
SCHEMBL30006191 0.89 SCN9A (0.47) LTA4HSCN9AHDAC4HDAC6SMN1; SMN2
SCHEMBL29123609 0.89 SCN9A (0.47) LTA4HSCN9AHDAC4HDAC6SMN1; SMN2
SCHEMBL29123464 0.89 SCN9A (0.41) LTA4HACACBSCN9AP2RX3PPARD
SCHEMBL30006188 0.89 LTA4H (0.46) LTA4HACACBKCNH2SCN9ATSHR
SCHEMBL24664144 0.89 LTA4H (0.46) LTA4HACACBKCNH2SCN9ATSHR
SCHEMBL27204690 0.88 LTA4H (0.49) LTA4HACACBKCNH2P2RX3PPARD
SCHEMBL27171411 0.88 LTA4H (0.49) LTA4HACACBKCNH2P2RX3PPARD
SCHEMBL24665315 0.83 PPARD (0.42) LTA4HACACBSCN9AP2RX3PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4628163-A1 NOVEL HETEROARYL AMINOPROPANOL DERIVATIVES Novartis AG (CH) 2025-10-08 — — EP disclosed
EP-4323062-B1 HETEROARYL AMINOPROPANOL DERIVATIVES AS INHIBITORS OF LTA4H NOVARTIS AG (CH) 2025-07-23 — — EP disclosed
US-20240199593-A1 Novel Heteroaryl Aminopropanol Derivatives NOVARTIS PHARMA AG (CH) 2024-06-20 — — US disclosed
US-11932630-B2 Heteroaryl aminopropanol derivatives NOVARTIS AG (CH) 2024-03-19 — — US disclosed
EP-4323062-A1 HETEROARYL AMINOPROPANOL DERIVATIVES AS INHIBITORS OF LTA4H Novartis AG (CH) 2024-02-21 — — EP disclosed
US-20220348566-A1 Novel Heteroaryl Aminopropanol Derivatives NOVARTIS AG (CH) 2022-11-03 — — US disclosed
WO-2022219546-A1 HETEROARYL AMINOPROPANOL DERIVATIVES AS INHIBITORS OF LTA4H NOVARTIS AG (CH) 2022-10-20 — — 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 (3 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-20220348566-A1 Novel Heteroaryl Aminopropanol Derivatives CYP11B2, CYP11B1, CYP3A43 LTA4H 953/4885ACACB 549/4885KCNH2 1671/4885
US-20240199593-A1 Novel Heteroaryl Aminopropanol Derivatives CYP3A43, CYP3A5, CYP51A1 LTA4H 1384/4885ACACB 961/4885KCNH2 3303/4885
US-11932630-B2 Heteroaryl aminopropanol derivatives CYP3A43, CYP11B2, ADRB3 LTA4H 1006/4885ACACB 648/4885KCNH2 1449/4885

“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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