SCHEMBL26658743

SCHEMBL26658743

O=c1[nH]ncc(N[C@H]2CCC[C@@H](Cn3ccc4nc(-c5ccc(C(F)(F)F)cn5)ccc4c3=O)C2)c1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TIPARP Q7Z3E1 15/20 0.37
▸ TNKS O95271 1/20 0.34
▸ PARP14 Q460N5 1/20 0.34
▸ PARP10 Q53GL7 1/20 0.34
▸ PARP12 Q9H0J9 1/20 0.34
▸ TNKS2 Q9H2K2 1/20 0.34
▸ PARP11 Q9NR21 1/20 0.34
▸ PARP2 Q9UGN5 1/20 0.34
▸ PARP1 P09874 1/20 0.33
▸ ROCK2 O75116 2/20 0.33
▸ ROCK1 Q13464 2/20 0.33
▸ KIT P10721 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ METAP2 P50579 1/20 0.32

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
SCHEMBL26658767 0.86 TIPARP (0.44) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL25904508 0.86 TIPARP (0.44) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL31058388 0.81 TIPARP (0.40) TIPARPROCK2ROCK1KITFLT3
SCHEMBL25904908 0.81 TIPARP (0.44) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL25904910 0.81 TIPARP (0.44) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL25904816 0.80 TIPARP (0.42) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL25320275 0.80 TIPARP (0.50) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL30550654 0.80 TIPARP (0.50) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL25903730 0.80 TIPARP (0.50) TIPARPTNKSPARP14PARP10PARP12
SCHEMBL25903612 0.80 TIPARP (0.50) TIPARPTNKSPARP14PARP10PARP12

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
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

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 491/4885TNKS 19/4885PARP14 10/4885

“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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