SCHEMBL30068131

SCHEMBL30068131

COc1cc(S(=O)(=O)C(C)C)cnc1N

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 3/20 0.39
▸ TP53 P04637 2/20 0.38
▸ P2RX3 P56373 3/20 0.37
▸ P2RX2 Q9UBL9 3/20 0.37
▸ ATM Q13315 4/20 0.36
▸ ATR Q13535 4/20 0.36
▸ GSK3B P49841 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ SHMT2 P34897 1/20 0.36
▸ QPCT Q16769 1/20 0.36
▸ QPCTL Q9NXS2 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ LOXL2 Q9Y4K0 1/20 0.35
▸ PRKDC P78527 2/20 0.35
▸ GABRA2 P47869 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
SCHEMBL26647049 1.00 FYN (0.39) FYNTP53P2RX3P2RX2ATM
SCHEMBL30068268 0.81 FYN (0.50) FYNTP53P2RX3P2RX2POLB
SCHEMBL26646776 0.81 FYN (0.50) FYNTP53P2RX3P2RX2POLB
SCHEMBL30829003 0.79 FYN (0.39) FYNTP53P2RX3P2RX2POLB
SCHEMBL26646913 0.79 FYN (0.39) FYNTP53P2RX3P2RX2POLB
SCHEMBL26805066 0.78 NOS3 (0.47) ATMATRGSK3BPRKDC
SCHEMBL26647445 0.77 MAPT (0.50) FYNTP53POLBTSHRMAPK1
SCHEMBL26646891 0.75 FYN (0.37) FYNTP53POLBTSHRMAPK1
SCHEMBL30828948 0.75 FYN (0.37) FYNTP53POLBTSHRMAPK1
SCHEMBL26771681 0.73 MAPT (0.51) POLBTSHRMAPK1

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-117794529-A POLO-like kinase 4 inhibitors 欧瑞克制药公司 2024-03-29 — — CN disclosed
EP-4337198-A1 POLO LIKE KINASE 4 INHIBITORS Oric Pharmaceuticals, Inc. (US) 2024-03-20 — — EP disclosed
WO-2022240876-A1 POLO LIKE KINASE 4 INHIBITORS ORIC PHARMACEUTICALS, INC. (US) 2022-11-17 — — WO disclosed
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