SCHEMBL30017759

SCHEMBL30017759

COC(=O)c1cc(CO)ncc1-c1c(F)cccc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLQ O75417 3/20 0.43
▸ PLA2G2A P14555 1/20 0.41
▸ GPBAR1 Q8TDU6 3/20 0.41
▸ HTR5A P47898 1/20 0.41
▸ LRRK2 Q5S007 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ CTSA P10619 3/20 0.39
▸ ABL1 P00519 2/20 0.39
▸ SRC P12931 1/20 0.39
▸ GABRA1 P14867 1/20 0.39
▸ GABRG2 P18507 1/20 0.39
▸ GABRB3 P28472 1/20 0.39
▸ GABRA5 P31644 1/20 0.39
▸ GABRA3 P34903 1/20 0.39
▸ GABRA2 P47869 1/20 0.39
▸ CHEK1 O14757 1/20 0.38
▸ AURKA O14965 1/20 0.38
▸ DAPK3 O43293 1/20 0.38
▸ JAK2 O60674 1/20 0.38
▸ NTRK1 P04629 1/20 0.38

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
SCHEMBL24770167 1.00 POLQ (0.43) POLQPLA2G2AGPBAR1HTR5ALRRK2
SCHEMBL22717429 0.91 POLQ (0.48) POLQPLA2G2AGPBAR1HTR5ALRRK2
SCHEMBL29694637 0.91 POLQ (0.48) POLQPLA2G2AGPBAR1HTR5ALRRK2
SCHEMBL29575480 0.91 POLQ (0.48) POLQPLA2G2AGPBAR1HTR5ALRRK2
SCHEMBL30017216 0.90 DHODH (0.42) POLQGPBAR1HTR5ALRRK2CTSA
SCHEMBL24770298 0.90 DHODH (0.42) POLQGPBAR1HTR5ALRRK2CTSA
SCHEMBL22717310 0.83 POLQ (0.46) POLQGPBAR1HTR5ALRRK2CTSA
SCHEMBL22717582 0.82 VDR (0.46) POLQPLA2G2AKDM4ESLC6A4SLC6A3
SCHEMBL29575360 0.82 VDR (0.46) POLQPLA2G2AKDM4ESLC6A4SLC6A3
SCHEMBL24501582 0.81 GRM7 (0.47) POLQ

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
EP-4352055-A1 O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS Ideaya Biosciences, Inc. (US) 2024-04-17 — — EP disclosed
WO-2022259204-A1 O-LINKED THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2022-12-15 — — WO disclosed
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