SCHEMBL22858693

SCHEMBL22858693

C[C@H](CNC(=O)c1ccc(Br)cc1)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ KMT2A Q03164 4/20 0.45
▸ OPRM1 P35372 1/20 0.45
▸ OPRD1 P41143 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ HPGD P15428 3/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ CYP24A1 Q07973 1/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ MLYCD O95822 1/20 0.42
▸ OGG1 O15527 1/20 0.41
▸ HSP90AA1 P07900 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ MEN1 O00255 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL28507567 1.00 ALDH1A1 (0.48) ALDH1A1KMT2AOPRM1OPRD1KDM4E
SCHEMBL28507569 1.00 ALDH1A1 (0.48) ALDH1A1KMT2AOPRM1OPRD1KDM4E
SCHEMBL22858947 0.86 TRPV1 (0.40) ALDH1A1KDM4EHPGDNPSR1SMN1; SMN2
SCHEMBL22859168 0.86 TRPV1 (0.40) ALDH1A1KDM4EHPGDNPSR1SMN1; SMN2
SCHEMBL28713773 0.86 TRPV1 (0.40) ALDH1A1KDM4EHPGDNPSR1SMN1; SMN2
SCHEMBL28502010 0.76 NPC1 (0.44) ALDH1A1KMT2AOPRM1OPRD1HPGD
SCHEMBL22858979 0.75 POLB (0.37) ALDH1A1KMT2AOPRM1OPRD1KDM4E
SCHEMBL28502196 0.75 POLB (0.37) ALDH1A1KMT2AOPRM1OPRD1KDM4E
SCHEMBL22859165 0.75 POLB (0.37) ALDH1A1KMT2AOPRM1OPRD1KDM4E
SCHEMBL889069 0.75 MLYCD (0.63) ALDH1A1KMT2AOPRM1OPRD1KDM4E

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12459958-B2 Tricyclic compounds as HPK1 inhibitor and the use thereof BEONE MEDICINES I GMBH (CH) 2025-11-04 — — US disclosed
US-12454534-B2 Pyrrolo[2,3-b]pyrazines as HPK1 inhibitor and the use thereof BEONE MEDICINES I GMBH (CH) 2025-10-28 — — US disclosed
CN-115073474-B Pyrrolo [2,3-b ] pyrazines as HPK1 inhibitors and uses thereof 百济神州有限公司 2024-10-18 — — CN disclosed
CN-114127067-B Tricyclic compounds as HPK1 inhibitors and uses thereof 百济神州有限公司 2024-08-23 — — CN disclosed
US-20220267354-A1 TRICYCLIC COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF BEONE MEDICINES I GMBH (CH) 2022-08-25 — — US disclosed
US-20220267333-A1 PYRROLO[2,3-b]PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF BEONE MEDICINES I GMBH (CH) 2022-08-25 — — US disclosed
EP-3994136-A1 PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF BeiGene, Ltd. (KY) 2022-05-11 — — EP disclosed
WO-2021013083-A1 TRICYCLIC COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF BEIGENE, LTD. (KY) 2021-01-28 — — WO disclosed
CN-112243439-A Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof 百济神州有限公司 2021-01-19 — — CN disclosed
WO-2021000925-A1 PYRROLO [2, 3-b] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF BEIGENE, LTD. (KY) 2021-01-07 — — WO 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 (4 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-20220267354-A1 TRICYCLIC COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF ULK1, SBK1, PHKG1 ALDH1A1 4406/4885KMT2A 2585/4885OPRM1 4242/4885
US-20220267333-A1 PYRROLO[2,3-b]PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF PDXK, STK25, STK35 ALDH1A1 3320/4885KMT2A 2605/4885OPRM1 4058/4885
US-12454534-B2 Pyrrolo[2,3-b]pyrazines as HPK1 inhibitor and the use thereof PDXK, STK25, STK35 ALDH1A1 3320/4885KMT2A 2605/4885OPRM1 4058/4885
US-12459958-B2 Tricyclic compounds as HPK1 inhibitor and the use thereof ULK1, SBK1, PHKG1 ALDH1A1 4406/4885KMT2A 2585/4885OPRM1 4242/4885

“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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