SCHEMBL24750230

SCHEMBL24750230

Cc1c(-c2nnc(NCCCc3ccccc3)o2)[nH]c2ccc(Cl)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 2/20 0.46
▸ PIK3CD O00329 1/20 0.43
▸ PIK3R1 P27986 1/20 0.43
▸ CNR1 P21554 3/20 0.42
▸ EGFR P00533 2/20 0.41
▸ CDK2 P24941 4/20 0.39
▸ CDC7 O00311 3/20 0.39
▸ CCNE1 P24864 3/20 0.39
▸ DBF4 Q9UBU7 3/20 0.39
▸ TP53 P04637 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MGAM O43451 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ SI P14410 1/20 0.37
▸ MGAM2 Q2M2H8 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36

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
SCHEMBL21801555 0.94 PTGS2 (0.49) PTGS2CNR1EGFRCDK2CDC7
SCHEMBL21801500 0.89 CDC7 (0.50) PTGS2CNR1EGFRCDK2CDC7
SCHEMBL21801557 0.83 CNR1 (0.52) PTGS2CNR1EGFRCDK2
SCHEMBL21801479 0.81 QPCT (0.48) PTGS2CNR1EGFRTP53GAA
SCHEMBL21801499 0.81 BCL2 (0.50) TP53MGAMGAASIMGAM2
SCHEMBL21801498 0.80 GSK3B (0.46) PTGS2CNR1EGFRTP53GAA
SCHEMBL21801526 0.77 CDC7 (0.48) CNR1CDK2CDC7CCNE1DBF4
SCHEMBL21801525 0.76 MAPT (0.53) EGFRTP53POLBSMN1; SMN2NPC1
SCHEMBL21801490 0.73 QPCT (0.44) CNR1NPC1RAB9ALMNAMAPT
SCHEMBL21801474 0.73 NPC1 (0.46) EGFRCDK2CDC7CCNE1DBF4

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2022-08-18 — — 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE CNR2, GPR119, CNR1 PTGS2 1785/4885PIK3CD 711/4885PIK3R1 973/4885

“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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