SCHEMBL30158153

SCHEMBL30158153

NC(=O)c1cc(F)cc2cn(C3CCCN(C4CCC4)C3)nc12

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 2/20 0.45
PARP1 P09874 15/20 0.44
PARP2 Q9UGN5 5/20 0.40
PARP3 Q9Y6F1 1/20 0.40
BTK Q06187 2/20 0.40
GAA P10253 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
SCHEMBL2267759 0.97 KDM2B (0.44) KDM2BPARP1PARP2PARP3BTK
SCHEMBL30157918 0.96 PARP1 (0.44) KDM2BPARP1PARP2PARP3
Trifluoroacetic Acid SCHEMBL2265487 0.94 KDM2B (0.41) KDM2BPARP1PARP2PARP3BTK
SCHEMBL30158024 0.92 PARP1 (0.48) KDM2BPARP1PARP2PARP3
Trifluoroacetic Acid SCHEMBL2264300 0.90 PARP1 (0.41) KDM2BPARP1PARP2PARP3BTK
SCHEMBL2266175 0.89 PARP1 (0.48) PARP1PARP2PARP3
Trifluoroacetic Acid SCHEMBL2265698 0.87 PARP1 (0.44) KDM2BPARP1PARP2PARP3BTK
SCHEMBL2264558 0.87 PARP1 (0.54) PARP1PARP2PARP3BTK
SCHEMBL2267080 0.86 BTK (0.45) PARP1PARP2BTK
SCHEMBL2267998 0.85 PARP1 (0.53) PARP1PARP2PARP3

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-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR FUKANG (SHANGHAI) HEALTH TECHNOLOGY CO., LTD (CN) 2024-01-18 US disclosed
EP-4112049-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR Fukang (Shanghai) Health Technology Co., Ltd. (CN) 2023-01-04 EP 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-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR PARP3, PARP1, PARP4 KDM2B 2129/4885PARP1 2/4885PARP2 14/4885

“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.