SCHEMBL30173715

SCHEMBL30173715

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ TRPV4 Q9HBA0 1/20 0.36
▸ PTGDR2 Q9Y5Y4 4/20 0.36
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ PTGES O14684 2/20 0.33
▸ ALOX5 P09917 2/20 0.33
▸ BRAF P15056 4/20 0.33
▸ PDE4A P27815 2/20 0.33
▸ PDE4B Q07343 2/20 0.33
▸ PDE4C Q08493 2/20 0.33
▸ PDE4D Q08499 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ FBP1 P09467 2/20 0.32
▸ FDFT1 P37268 1/20 0.32

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
SCHEMBL23782471 1.00 NPC1 (0.37) NPC1LMNAPOLBRAB9ATRPV4
SCHEMBL23782347 0.92 TRPV4 (0.37) NPC1LMNAPOLBRAB9ATRPV4
SCHEMBL23782516 0.90 TEAD2 (0.37) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL30173731 0.90 TEAD2 (0.37) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23792708 0.85 PTGDR2 (0.45) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23792710 0.84 PTGDR2 (0.44) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23782532 0.83 POLB (0.42) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23792441 0.82 LMNA (0.38) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL26240315 0.82 NPC1 (0.38) NPC1LMNAPOLBRAB9APTGDR2
SCHEMBL23782543 0.82 TEAD2 (0.40) 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 3 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
EP-4114529-A1 EIF4E INHIBITORS AND USES THEREOF PIC Therapeutics, Inc. (US) 2023-01-11 — — EP disclosed
CN-115515685-A EIF4E inhibitor and application thereof 皮克医疗公司 2022-12-23 — — CN disclosed
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