SCHEMBL30157780

SCHEMBL30157780

NC(=O)c1cc(F)cc2cn(CCC(=O)O)nc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 13/20 0.47
PDE4B Q07343 1/20 0.36
PDE4D Q08499 1/20 0.36
MPO P05164 1/20 0.35
HPGD P15428 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PARP2 Q9UGN5 2/20 0.35
PLA2G10 O15496 1/20 0.35
PLA2G2A P14555 1/20 0.35
PARP3 Q9Y6F1 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL2264171 0.83 PARP1 (0.47) PARP1PARP2
Trifluoroacetic Acid SCHEMBL2266026 0.82 PARP1 (0.44) PARP1
SCHEMBL4768133 0.82 PARP1 (0.50) PARP1PARP2
SCHEMBL25336534 0.80 PARP1 (0.67) PARP1PARP2PARP3
Trifluoroacetic Acid SCHEMBL2264952 0.78 PARP1 (0.43) PARP1PARP2PARP3
Trifluoroacetic Acid SCHEMBL27738233 0.77 PARP1 (0.47) PARP1PARP2
Ammonia Solution, Strong SCHEMBL28920665 0.77 PARP1 (0.44) PARP1
SCHEMBL2266058 0.77 PARP1 (0.43) PARP1PARP2PARP3
Trifluoroacetic Acid SCHEMBL2263871 0.77 PARP1 (0.42) PARP1
Trifluoroacetic Acid SCHEMBL27738194 0.77 PARP1 (0.40) 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 PARP1 2/4885PDE4B 2888/4885PDE4D 3159/4885

“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.