SCHEMBL20847265

SCHEMBL20847265

Cc1c(C=O)ccc2c1cc(C#N)n2C[C@H](C)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.36
▸ RET P07949 6/20 0.36
▸ NSD2 O96028 2/20 0.36
▸ KCNH2 Q12809 1/20 0.35
▸ IRAK4 Q9NWZ3 1/20 0.35
▸ CHRM2 P08172 1/20 0.34
▸ CHRM4 P08173 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ CHRM3 P20309 1/20 0.34
▸ CETP P11597 2/20 0.34
▸ CCNC P24863 1/20 0.33
▸ CDK8 P49336 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP3A5 P20815 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33

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
SCHEMBL29480900 1.00 CNR2 (0.36) CNR2RETNSD2KCNH2IRAK4
SCHEMBL19358796 1.00 CNR2 (0.36) CNR2RETNSD2KCNH2IRAK4
SCHEMBL19358789 0.86 DTYMK (0.43) CNR2NSD2KCNH2IRAK4CHRM2
SCHEMBL29480889 0.86 DTYMK (0.43) CNR2NSD2KCNH2IRAK4CHRM2
SCHEMBL17596556 0.85 GPR119 (0.40) CNR2NSD2IRAK4CETPGPR119
SCHEMBL16156345 0.85 PLK1 (0.42) CNR2NSD2KCNH2CHRM2CHRM4
SCHEMBL31579034 0.83 CNR2 (0.44) CNR2NSD2KCNH2CHRM2CHRM4
SCHEMBL31578956 0.80 KDM4E (0.36) —
SCHEMBL17596606 0.78 GPR119 (0.37) CNR2RETGPR119
SCHEMBL19358788 0.77 SETD7 (0.37) IRAK4CHRM2CHRM4CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250152591-A1 TREATMENT OF HEMATOLOGICAL MALIGNANCIES WITH MENIN INHIBITORS AND P-GLYCOPROTEIN INHIBITORS KURA ONCOLOGY INC (US) 2025-05-15 — — US disclosed
EP-4472637-A1 TREATMENT OF HEMATOLOGICAL MALIGNANCIES WITH MENIN INHIBITORS AND P-GLYCOPROTEIN INHIBITORS Kura Oncology, Inc. (US) 2024-12-11 — — EP disclosed
WO-2023150635-A1 TREATMENT OF HEMATOLOGICAL MALIGNANCIES WITH MENIN INHIBITORS AND P-GLYCOPROTEIN INHIBITORS KURA ONCOLOGY, INC. (US) 2023-08-10 — — WO disclosed
WO-2023150635-A1 TREATMENT OF HEMATOLOGICAL MALIGNANCIES WITH MENIN INHIBITORS AND P-GLYCOPROTEIN INHIBITORS KURA ONCOLOGY, INC. (US) 2023-08-10 — — WO disclosed
US-11649251-B2 Substituted inhibitors of menin-MLL and methods of use KURA ONCOLOGY, INC. (US) 2023-05-16 — — US disclosed
WO-2019060365-A1 SUBSTITUTED INHIBITORS OF MENIN-MLL AND METHODS OF USE KURA ONCOLOGY, INC. (US) 2019-03-28 — — 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-20250152591-A1 TREATMENT OF HEMATOLOGICAL MALIGNANCIES WITH MENIN INHIBITORS AND P-GLYCOPROTEIN INHIBITORS MEN1, ABCB1, ABCC1 CNR2 4864/4885RET 1100/4885NSD2 1585/4885
US-11649251-B2 Substituted inhibitors of menin-MLL and methods of use MLLT1, MEN1, MLLT3 CNR2 4601/4885RET 495/4885NSD2 51/4885

“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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