SCHEMBL25904512

SCHEMBL25904512

O=c1[nH]ncc(N[C@H]2CCC[C@@H](Cn3ccc4cc(-c5cnc(C6CC6)cn5)c(F)cc4c3=O)C2)c1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TIPARP Q7Z3E1 10/20 0.43
▸ FLT3 P36888 2/20 0.33
▸ KIT P10721 1/20 0.33
▸ GRM4 Q14833 1/20 0.33
▸ CHEK1 O14757 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
SCHEMBL26658918 0.95 TIPARP (0.43) TIPARPFLT3KITGRM4
SCHEMBL26658809 0.93 TIPARP (0.44) TIPARPFLT3KITGRM4CHEK1
SCHEMBL25904618 0.91 TIPARP (0.45) TIPARPFLT3KITGRM4CHEK1
SCHEMBL26658685 0.91 TIPARP (0.45) TIPARPFLT3KITGRM4CHEK1
SCHEMBL25904241 0.91 TIPARP (0.46) TIPARPFLT3KITGRM4CHEK1
SCHEMBL25904434 0.90 TIPARP (0.44) TIPARPFLT3KITGRM4CHEK1
SCHEMBL25904508 0.90 TIPARP (0.44) TIPARPFLT3KITGRM4
SCHEMBL26658767 0.90 TIPARP (0.44) TIPARPFLT3KITGRM4
SCHEMBL26658718 0.89 TIPARP (0.46) TIPARPFLT3KITGRM4CHEK1
SCHEMBL25903814 0.89 TIPARP (0.49) TIPARPFLT3KITGRM4CHEK1

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
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 — — US disclosed
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 — — US disclosed
WO-2023147418-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2023-08-03 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 TIPARP 491/4885FLT3 2225/4885KIT 826/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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