SCHEMBL30005383

SCHEMBL30005383

CC(C)(C)OC(=O)N[C@H](CO)Cc1nc(-c2cccc(Oc3ccc(OC(F)F)cn3)c2)no1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.38
▸ MAPT P10636 2/20 0.37
▸ SCN9A Q15858 3/20 0.36
▸ FFAR1 O14842 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ PKM P14618 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ GRN P28799 2/20 0.34
▸ SORT1 Q99523 2/20 0.34
▸ IDH1 O75874 2/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34

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
SCHEMBL24665373 1.00 LTA4H (0.38) LTA4HMAPTSCN9AFFAR1THRB
SCHEMBL30006457 0.92 LTA4H (0.45) LTA4HSCN9AHDAC6KCNH2
SCHEMBL29123526 0.90 PTPN1 (0.42) MAPTSCN9AFFAR1THRBGRN
SCHEMBL27243633 0.89 LTA4H (0.40) LTA4HMAPTSCN9AFFAR1THRB
SCHEMBL27243634 0.89 LTA4H (0.40) LTA4HMAPTSCN9AFFAR1THRB
SCHEMBL29123536 0.89 MAPK1 (0.42) MAPTSCN9AFFAR1HDAC1HDAC6
SCHEMBL24664167 0.89 MAPK1 (0.42) MAPTSCN9AFFAR1HDAC1HDAC6
SCHEMBL24665367 0.89 LTA4H (0.38) LTA4HMAPTFFAR1THRBPKM
SCHEMBL30006150 0.89 LTA4H (0.38) LTA4HMAPTFFAR1THRBPKM
SCHEMBL24665374 0.86 PTPN1 (0.39) MAPTSCN9AFFAR1GRNSORT1

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 953/4885MAPT 3003/4885SCN9A 1243/4885
US-20240199593-A1 Novel Heteroaryl Aminopropanol Derivatives CYP3A43, CYP3A5, CYP51A1 LTA4H 1384/4885MAPT 462/4885SCN9A 2922/4885
US-11932630-B2 Heteroaryl aminopropanol derivatives CYP3A43, CYP11B2, ADRB3 LTA4H 1006/4885MAPT 2923/4885SCN9A 1338/4885

“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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