SCHEMBL23791795

SCHEMBL23791795

Cc1cc(-c2nc(NCC(Cc3cccc(C(=O)N(C)C)c3)C(=O)O)sc2CC(C)C)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 5/20 0.40
▸ LIPG Q9Y5X9 2/20 0.37
▸ PTGDR2 Q9Y5Y4 3/20 0.35
▸ NR1H4 Q96RI1 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ PCSK9 Q8NBP7 3/20 0.33
▸ LIPC P11150 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ ITK Q08881 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HIF1A Q16665 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
SCHEMBL23782405 0.94 FYN (0.41) FYNLIPGPTGDR2NPC1PCSK9
SCHEMBL30173863 0.94 FYN (0.41) FYNLIPGPTGDR2NPC1PCSK9
SCHEMBL23792465 0.91 FOLH1 (0.39) FYNPTGDR2NR1H4ADORA2AADORA1
SCHEMBL23791794 0.90 FYN (0.38) FYNLIPGPTGDR2NR1H4PCSK9
SCHEMBL23792378 0.86 PTGDR2 (0.36) PTGDR2NR1H4PCSK9MAPTTSHR
SCHEMBL26240327 0.85 FOLH1 (0.41) FYNPTGDR2NPC1ADORA2AADORA1
SCHEMBL23782588 0.84 FYN (0.38) FYNLIPGPTGDR2NPC1PCSK9
SCHEMBL23791715 0.83 SLC7A5 (0.41) FYNPTGDR2NR1H4NPC1PCSK9
SCHEMBL23792710 0.82 PTGDR2 (0.44) PTGDR2NPC1LMNAMAPT
SCHEMBL23792699 0.81 PTGDR2 (0.39) PTGDR2NR1H4NPC1LMNA

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
WO-2021178488-A1 EIF4E INHIBITORS AND USES THEREOF PIC Therapeutics, Inc. (US) 2021-09-10 — — WO disclosed
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