Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 3/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | FPR3 | P25089 | 2/20 | 0.40 |
| ▸ | FPR2 | P25090 | 2/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22014536 | 0.89 | TACR1 (0.48) | GPR119TACR1 | |
| SCHEMBL15549442 | 0.84 | FPR2 (0.53) | PKMMAPK1FPR2 | |
| SCHEMBL28974221 | 0.81 | GPR119 (0.46) | MMP13PKMGPR119 | |
| SCHEMBL28974232 | 0.81 | NAMPT (0.54) | PKMGPR119JAK2JAK1HDAC1 | |
| SCHEMBL28775254 | 0.81 | TACR1 (0.40) | PKMGPR119TACR1 | |
| SCHEMBL16445132 | 0.80 | GPR119 (0.41) | MMP13ADAM17MMP2PKMMMP14 | |
| SCHEMBL23023931 | 0.80 | PKM (0.56) | MMP13ADAM17MMP2PKMMMP14 | |
| SCHEMBL4326509 | 0.80 | LMNA (0.51) | SMN1; SMN2TACR1 | |
| SCHEMBL28986539 | 0.80 | USP2 (0.45) | MMP13ADAM17MMP2PKMMMP14 | |
| SCHEMBL20511877 | 0.79 | PKM (0.40) | MMP13ADAM17MMP2PKMMMP14 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115969853-A | Novel heterocyclic derivatives useful as SHP2 inhibitors | 北京加科思新药研发有限公司 | 2023-04-18 | — | — | CN | disclosed |
| CN-115721648-A | Novel heterocyclic derivatives useful as SHP2 inhibitors | 北京加科思新药研发有限公司 | 2023-03-03 | — | — | CN | disclosed |
| CN-112409334-B | Heterocyclic derivatives useful as SHP2 inhibitors | 北京加科思新药研发有限公司 | 2022-12-02 | — | — | CN | disclosed |
| CN-114008035-A | SHP2 phosphatase allosteric inhibitor | 北京盛诺基医药科技股份有限公司 | 2022-02-01 | — | — | CN | disclosed |
| CN-112409334-A | Novel heterocyclic derivatives useful as SHP2 inhibitors | 北京加科思新药研发有限公司 | 2021-02-26 | — | — | CN | disclosed |