SCHEMBL24414562

SCHEMBL24414562

CC(C)(C)OC(=O)NCCCn1ccc2ccc(CN)cc21

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 5/20 0.42
▸ MTNR1B P49286 5/20 0.42
▸ DRD2 P14416 3/20 0.42
▸ MCL1 Q07820 1/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ HDAC6 Q9UBN7 2/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40

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
SCHEMBL30991815 1.00 MTNR1A (0.42) MTNR1AMTNR1BDRD2MCL1CA1
SCHEMBL29208507 0.84 NAMPT (0.37) DRD2CA1CA2HDAC8
SCHEMBL29208505 0.84 EP300 (0.42) CA1CA2HDAC6HDAC1HDAC8
SCHEMBL29208400 0.83 HDAC8 (0.47) CA1CA2HDAC6HDAC1HDAC8
SCHEMBL24414605 0.82 KDM4E (0.47) MTNR1AMTNR1BMCL1HDAC6HDAC1
SCHEMBL29208492 0.79 BRD9 (0.44) HDAC6HDAC1HDAC8
SCHEMBL29588065 0.79 BRD9 (0.44) HDAC6HDAC1HDAC8
SCHEMBL17997425 0.78 MTNR1A (0.60) MTNR1AMTNR1BHDAC6HDAC1HDAC8
SCHEMBL7672969 0.77 MTNR1A (0.51) MTNR1AMTNR1B
SCHEMBL7671707 0.77 KMO (0.54) MTNR1AMTNR1BDRD2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12281099-B2 Isoindolinone substituted indoles and derivatives as RAS inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2025-04-22 — — US disclosed
EP-3931188-B1 NEW ISOINDOLINONE SUBSTITUTED INDOLES AND DERIVATIVES AS RAS INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-08-30 — — EP disclosed
US-20220144810-A1 NEW ISOINDOLINONE SUBSTITUTED INDOLES AND DERIVATIVES AS RAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-05-12 — — US disclosed
US-20220144810-A1 NEW ISOINDOLINONE SUBSTITUTED INDOLES AND DERIVATIVES AS RAS INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-05-12 — — US disclosed
CN-113474340-A Novel isoindolinone substituted indoles and derivatives as RAS inhibitors 勃林格殷格翰国际有限公司 2021-10-01 — — CN 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-12281099-B2 Isoindolinone substituted indoles and derivatives as RAS inhibitors NRAS, KRAS, RASSF5 MTNR1A 1048/4885MTNR1B 1440/4885DRD2 1253/4885
US-20220144810-A1 NEW ISOINDOLINONE SUBSTITUTED INDOLES AND DERIVATIVES AS RAS INHIBITORS NRAS, RASSF5, KRAS MTNR1A 1100/4885MTNR1B 1459/4885DRD2 1107/4885

“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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