Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20152907 | 0.91 | PARP1 (0.42) | ALDH1A1NPC1RAB9ASMN1; SMN2PARP1 | |
| SCHEMBL20036990 | 0.83 | NR1H2 (0.49) | ALDH1A1PARP1TNKS2PARP2HTT | |
| SCHEMBL1976458 | 0.73 | MEN1 (0.47) | ALDH1A1NPC1RAB9ASMN1; SMN2TMEM97 | |
| SCHEMBL20036994 | 0.72 | KDM4E (0.43) | ALDH1A1PARP1MEN1KMT2ATSHR | |
| SCHEMBL1964904 | 0.72 | MEN1 (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2TMEM97 | |
| SCHEMBL839899 | 0.71 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9ASMN1; SMN2TMEM97 | |
| SCHEMBL10095052 | 0.70 | PDK2 (0.54) | NPC1RAB9ASMN1; SMN2TMEM97SIGMAR1 | |
| SCHEMBL21809822 | 0.70 | HTT (0.47) | ALDH1A1NPC1RAB9ASMN1; SMN2TMEM97 | |
| SCHEMBL1967826 | 0.69 | MEN1 (0.48) | NPC1RAB9ASMN1; SMN2TMEM97SIGMAR1 | |
| SCHEMBL839900 | 0.69 | RAB9A (0.60) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180134722-A1 | AZA-PHENALENE-3-KETONE DERIVATIVE, PREPARATION METHOD THEREOF, AND ITS APPLICATION AS PARP INHIBITOR | SUZHOU KANGRUN PHARMACEUTICALS INC. (CN) | 2018-05-17 | — | — | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20180134722-A1 | AZA-PHENALENE-3-KETONE DERIVATIVE, PREPARATION METHOD THEREOF, AND ITS APPLICATION AS PARP INHIBITOR | PARP1, PARP11, PARP3 | ALDH1A1 812/4885NPC1 3714/4885RAB9A 3973/4885 |
“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.