SCHEMBL30173718

SCHEMBL30173718

CC(C)Cc1sc(NCC(N)C(=O)O)nc1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ PTGDR2 Q9Y5Y4 4/20 0.40
▸ SLC1A3 P43003 1/20 0.39
▸ SLC1A2 P43004 1/20 0.39
▸ SLC1A1 P43005 1/20 0.39
▸ BRAF P15056 6/20 0.38
▸ PDE4A P27815 5/20 0.38
▸ PDE4B Q07343 5/20 0.38
▸ PDE4C Q08493 5/20 0.38
▸ PDE4D Q08499 5/20 0.38
▸ KMO O15229 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ RCE1 Q9Y256 1/20 0.36
▸ FBP1 P09467 2/20 0.36
▸ GRN P28799 1/20 0.35
▸ SORT1 Q99523 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
SCHEMBL23782388 1.00 NPC1 (0.41) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23791891 0.90 NPC1 (0.40) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23782532 0.86 POLB (0.42) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23792330 0.86 NPC1 (0.43) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL26240299 0.85 GRN (0.40) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23792015 0.84 GRN (0.40) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23792710 0.84 PTGDR2 (0.44) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23782516 0.84 TEAD2 (0.37) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL30173731 0.84 TEAD2 (0.37) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23791714 0.83 BRAF (0.38) NPC1LMNAPOLBRAB9APTGDR2

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-115515685-B EIF4E inhibitors and uses thereof 皮克医疗公司 2025-04-08 — — CN disclosed
CN-115515685-A EIF4E inhibitor and application thereof 皮克医疗公司 2022-12-23 — — CN disclosed
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