SCHEMBL30550762

SCHEMBL30550762

O=c1[nH]ncc(N[C@H]2CCC[C@@H](Cn3ccc4cc(-c5cc6c(cn5)C(F)(F)CC6)c(F)cc4c3=O)C2)c1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TIPARP Q7Z3E1 9/20 0.42
▸ KIT P10721 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ GRM4 Q14833 1/20 0.31

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
SCHEMBL25322327 1.00 TIPARP (0.42) TIPARPKITFLT3GRM4
SCHEMBL26804516 0.87 TIPARP (0.33) TIPARPGRM4
SCHEMBL26658809 0.86 TIPARP (0.44) TIPARPKITFLT3GRM4
SCHEMBL26658767 0.86 TIPARP (0.44) TIPARPKITFLT3GRM4
SCHEMBL25904508 0.86 TIPARP (0.44) TIPARPKITFLT3GRM4
SCHEMBL25904618 0.86 TIPARP (0.45) TIPARPKITFLT3GRM4
SCHEMBL26658685 0.86 TIPARP (0.45) TIPARPKITFLT3GRM4
SCHEMBL26658718 0.86 TIPARP (0.46) TIPARPKITFLT3GRM4
SCHEMBL25904512 0.86 TIPARP (0.43) TIPARPKITFLT3GRM4
SCHEMBL25904734 0.85 TIPARP (0.44) TIPARPKITFLT3GRM4

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
EP-4469448-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2024-12-04 — — EP disclosed
CN-118591537-A PARP7 inhibitors 吉利德科学公司 2024-09-03 — — CN disclosed
WO-2023147418-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2023-08-03 — — WO disclosed
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