SCHEMBL24414580

SCHEMBL24414580

Cn1cnc(Cn2ccc3ccc(CN)cc32)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 1/20 0.42
▸ SOS1 Q07889 1/20 0.42
▸ CYP2C9 P11712 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ HRH4 Q9H3N8 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ HDAC8 Q9BY41 2/20 0.35
▸ BRD4 O60885 3/20 0.35
▸ HTR6 P50406 2/20 0.34
▸ HTR7 P34969 1/20 0.34
▸ KLKB1 P03952 1/20 0.34
▸ KLK1 P06870 1/20 0.34
▸ F2 P00734 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HDAC3 O15379 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
SCHEMBL30991780 1.00 KRAS (0.42) KRASSOS1CYP2C9TSHRCYP2C19
SCHEMBL29288341 0.80 HTR2C (0.39) KRASSOS1CYP2C9TSHRCYP2C19
SCHEMBL30991791 0.79 CDC7 (0.41) KRASSOS1CYP2C9TSHRCYP2C19
SCHEMBL24414579 0.79 CDC7 (0.41) KRASSOS1CYP2C9TSHRCYP2C19
SCHEMBL24414784 0.78 KMT2A (0.36) HDAC8BRD4HTR6HTR7KLKB1
SCHEMBL30991773 0.78 KMT2A (0.36) HDAC8BRD4HTR6HTR7KLKB1
SCHEMBL25426067 0.76 CPB2 (0.36) KRASSOS1HDAC8KLKB1KLK1
SCHEMBL29208495 0.76 ADA (0.35) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL29208507 0.73 NAMPT (0.37) CYP2C9CYP2C19HDAC8BRD4
SCHEMBL24414631 0.72 HTR6 (0.57) HDAC8BRD4HTR6F2F10

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-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

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 KRAS 2/4885SOS1 80/4885CYP2C9 3342/4885
US-20220144810-A1 NEW ISOINDOLINONE SUBSTITUTED INDOLES AND DERIVATIVES AS RAS INHIBITORS NRAS, RASSF5, KRAS KRAS 3/4885SOS1 79/4885CYP2C9 3459/4885

“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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