SCHEMBL30124385

SCHEMBL30124385

COc1c(-c2ccnc(F)c2)cc(Cl)cc1-c1ccc(-n2ccn(C)c2=O)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 1/20 0.37
▸ ADORA2B P29275 1/20 0.35
▸ PDE2A O00408 2/20 0.33
▸ EPHB4 P54760 2/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ DYRK1A Q13627 1/20 0.31
▸ PTGS2 P35354 2/20 0.31
▸ GRM4 Q14833 2/20 0.31
▸ TNIK Q9UKE5 1/20 0.31
▸ FABP4 P15090 2/20 0.31
▸ FABP5 Q01469 2/20 0.31
▸ PARP10 Q53GL7 1/20 0.31
▸ PARP11 Q9NR21 1/20 0.31
▸ FABP3 P05413 1/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ GRM1 Q13255 1/20 0.30

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
SCHEMBL30124439 0.94 CAPN1 (0.37) CAPN1ADORA2BPDE2AEPHB4PDE10A
SCHEMBL30124086 0.93 CAPN1 (0.36) CAPN1ADORA2BPDE2AEPHB4PDE10A
SCHEMBL24951645 0.92 CAPN1 (0.38) CAPN1ADORA2BPDE2AEPHB4PDE10A
SCHEMBL30124783 0.92 L3MBTL1 (0.37) CAPN1ADORA2BPDE2AEPHB4PDE10A
SCHEMBL30124429 0.89 CAPN1 (0.36) CAPN1ADORA2BPDE2AEPHB4PDE10A
SCHEMBL30124208 0.86 GRM1 (0.32) CAPN1EPHB4GRM4PARP10PARP11
SCHEMBL30124611 0.85 CAPN1 (0.35) CAPN1GRM4GRM1
SCHEMBL24720828 0.85 CAPN1 (0.35) CAPN1GRM4GRM1
SCHEMBL30124144 0.83 PDE3B (0.35) PDE2APDE10ADYRK1APARP10PARP11
SCHEMBL24719482 0.82 CAPN1 (0.42) CAPN1EPHB4GRM4PARP10PARP11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12162870-B2 Anticancer compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-12-10 — — US disclosed
EP-4351560-A1 ANTICANCER COMPOUNDS The Regents of the University of California (US) 2024-04-17 — — EP disclosed
US-20230025178-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-01-26 — — US disclosed
WO-2022261204-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-12-15 — — 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 (2 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-20230025178-A1 ANTICANCER COMPOUNDS BET1, BRD4, BICRA CAPN1 4297/4885ADORA2B 4040/4885PDE2A 4844/4885
US-12162870-B2 Anticancer compounds BET1, BRD4, BICRA CAPN1 4297/4885ADORA2B 4040/4885PDE2A 4844/4885

“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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