SCHEMBL24665285

SCHEMBL24665285

Fc1cc(Cl)cnc1Oc1cccc(-c2cc[nH]n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 10/20 0.41
▸ KCNH2 Q12809 5/20 0.41
▸ PPARG P37231 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ IP6K1 Q92551 1/20 0.37
▸ IP6K3 Q96PC2 1/20 0.37
▸ IP6K2 Q9UHH9 1/20 0.37
▸ GRIN2D O15399 3/20 0.36
▸ GRIN3B O60391 3/20 0.36
▸ GRIN1 Q05586 3/20 0.36
▸ GRIN2A Q12879 3/20 0.36
▸ GRIN2B Q13224 3/20 0.36
▸ GRIN2C Q14957 3/20 0.36
▸ GRIN3A Q8TCU5 3/20 0.36
▸ PLAU P00749 1/20 0.36
▸ EGFR P00533 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
SCHEMBL30731795 1.00 LTA4H (0.41) LTA4HKCNH2PPARGLMNACYP2C9
SCHEMBL24664799 0.86 LTA4H (0.51) LTA4HKCNH2LMNACYP2C9TSHR
SCHEMBL24665459 0.82 LMNA (0.43) LTA4HKCNH2PPARGLMNACYP2C9
SCHEMBL24665284 0.75 EGFR (0.49) LTA4HKCNH2PPARGLMNACYP2C9
SCHEMBL30731729 0.75 EGFR (0.49) LTA4HKCNH2PPARGLMNACYP2C9
SCHEMBL29123547 0.74 LMNA (0.50) LTA4HKCNH2LMNACYP2C9TSHR
SCHEMBL27753623 0.72 PIK3CD (0.44) LTA4HLMNACYP2C9TSHRSMN1; SMN2
SCHEMBL24665287 0.72 LTA4H (0.57) LTA4HKCNH2PPARGCYP2C9
SCHEMBL13710426 0.71 IDO1 (0.38) LMNABACE1MAPK1
SCHEMBL746593 0.70 IDO1 (0.56) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117015537-A Heteroaryl aminopropanol derivatives as inhibitors of LTA4H 诺华股份有限公司 2023-11-07 — — CN disclosed
WO-2022219546-A1 HETEROARYL AMINOPROPANOL DERIVATIVES AS INHIBITORS OF LTA4H NOVARTIS AG (CH) 2022-10-20 — — WO disclosed
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