SCHEMBL29255152

SCHEMBL29255152

CC(C)(C)OC(=O)N1CC(n2nnc(-c3ccc(Oc4ncc(Cl)cc4F)cc3)n2)CC1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 9/20 0.49
KCNH2 Q12809 5/20 0.49
BTK Q06187 10/20 0.39
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
EGFR P00533 6/20 0.38

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
SCHEMBL29254757 0.87 LTA4H (0.52) LTA4HKCNH2BTKEGFR
SCHEMBL1068111 0.81 HSD17B10 (0.43) LTA4HABL1BCR
SCHEMBL1068114 0.81 HSD17B10 (0.43) LTA4HABL1BCR
SCHEMBL31086450 0.80 LTA4H (0.41) LTA4HKCNH2BTKEGFR
SCHEMBL29255083 0.80 LTA4H (0.41) LTA4HKCNH2BTKEGFR
SCHEMBL29255082 0.80 LTA4H (0.41) LTA4HKCNH2BTKEGFR
SCHEMBL31086522 0.79 PRCP (0.39) LTA4HKCNH2BTK
SCHEMBL1131364 0.79 SRC (0.42)
SCHEMBL29255114 0.78 LTA4H (0.60) LTA4HKCNH2BTKEGFR
SCHEMBL31086326 0.78 LTA4H (0.60) LTA4HKCNH2BTKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307534-A LTA4H inhibitors and uses thereof 上海海雁医药科技有限公司 2024-07-09 CN disclosed