SCHEMBL31211252

SCHEMBL31211252

COc1nc2c(C(=O)Nc3cc(F)c4nc(C)cn4c3)ccc(N3CCN(C(=O)OC(C)(C)C)CC3)c2s1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.39
▸ MAPT P10636 6/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ BACE1 P56817 5/20 0.38
▸ GALR2 O43603 1/20 0.38
▸ GALR1 P47211 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ SMPD3 Q9NY59 1/20 0.37
▸ ALK Q9UM73 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ GPR35 Q9HC97 1/20 0.36
▸ GPR55 Q9Y2T6 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TP53 P04637 2/20 0.36

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
SCHEMBL31210572 0.88 WDR5 (0.34) MAPTTHRBCNR1NPSR1GPR35
SCHEMBL31210796 0.87 ENPP1 (0.38) USP30
SCHEMBL31210868 0.87 ALDH1A1 (0.39) BACE1
SCHEMBL30312613 0.86 PTPN11 (0.44) PTPN11MAPTMEN1TSHRKMT2A
SCHEMBL31211475 0.85 ENPP1 (0.39) MAPTSMN1; SMN2TP53
SCHEMBL25096320 0.85 PTPN11 (0.46) PTPN11MAPTMEN1TSHRKMT2A
SCHEMBL30217787 0.85 PTPN11 (0.46) PTPN11MAPTMEN1TSHRKMT2A
SCHEMBL25095913 0.85 MAPT (0.44) PTPN11MAPTMEN1TSHRKMT2A
SCHEMBL25095784 0.85 BACE1 (0.40) PTPN11MAPTMEN1TSHRKMT2A
SCHEMBL30217607 0.85 MAPT (0.44) PTPN11MAPTMEN1TSHRKMT2A

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-2024182778-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING REMIX THERAPEUTICS INC. (US) 2024-09-06 — — WO disclosed
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