SCHEMBL29271248

SCHEMBL29271248

B1OOCC1c1cnn(C2CCCCO2)c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ CYP4F2 P78329 2/20 0.30
▸ CYP4A11 Q02928 2/20 0.30

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
SCHEMBL14167640 0.82 ACHE (0.40) —
SCHEMBL29138047 0.79 ACHE (0.33) —
SCHEMBL25275730 0.78 KDM5B (0.39) KDM5BALDH1A1LMNAPOLBCYP4F2
SCHEMBL34468717 0.77 KDM5B (0.38) KDM5BALDH1A1LMNAPOLBCYP4F2
SCHEMBL25232797 0.76 KDM5B (0.39) KDM5BALDH1A1LMNAPOLBCYP4F2
SCHEMBL15465245 0.75 KDM5B (0.36) KDM5BALDH1A1LMNAPOLBCYP4F2
SCHEMBL16290188 0.75 KDM5B (0.36) KDM5BALDH1A1LMNAPOLBCYP4F2
SCHEMBL15465247 0.75 KDM5B (0.36) KDM5BALDH1A1LMNAPOLBCYP4F2
SCHEMBL34468712 0.75 KDM5B (0.36) KDM5BALDH1A1LMNAPOLBCYP4F2
SCHEMBL17675635 0.74 KDM5B (0.38) KDM5BALDH1A1LMNAPOLBCYP4F2

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-118284604-A Fused heterocycles as RIPK1 inhibitors 比西切姆有限公司 2024-07-02 — — CN disclosed
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