SCHEMBL30104233

SCHEMBL30104233

C=CC(=O)N1CCN(C(=O)CNc2cc(-c3ccccc3Cl)c(Cl)cc2OC)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 6/20 0.53
▸ GAA P10253 1/20 0.45
▸ SCD O00767 5/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ EGFR P00533 3/20 0.40
▸ HTR1A P08908 1/20 0.38
▸ HTR1D P28221 1/20 0.38
▸ HTR1B P28222 1/20 0.38
▸ HTR7 P34969 1/20 0.38

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
SCHEMBL16102800 1.00 KRAS (0.53) KRASGAASCDMEN1KMT2A
SCHEMBL16117727 0.94 KRAS (0.50) KRASGAASCDMEN1KMT2A
SCHEMBL16117734 0.92 KRAS (0.48) KRASGAASCDMEN1KMT2A
SCHEMBL16122843 0.92 KRAS (0.51) KRASGAASCDMEN1KMT2A
SCHEMBL16122820 0.92 KRAS (0.47) KRASGAASCDEGFR
SCHEMBL16122689 0.92 KRAS (0.48) KRASGAASCDKMT2AEGFR
SCHEMBL16117783 0.90 KRAS (0.48) KRASGAASCDMEN1KMT2A
SCHEMBL16122760 0.90 KRAS (0.53) KRASGAAMEN1KMT2AEGFR
SCHEMBL16122813 0.90 KRAS (0.53) KRASGAAMEN1KMT2AEGFR
SCHEMBL16117750 0.90 KRAS (0.50) KRASGAASCDMEN1KMT2A

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-20250281607-A1 MEDICAMENT FOR TREATMENT AND/OR PREVENTION OF CANCER TORAY INDUSTRIES, INC. (JP) 2025-09-11 — — US disclosed
EP-4378478-A1 MEDICAMENT FOR TREATMENT AND/OR PREVENTION OF CANCER Toray Industries, Inc. (JP) 2024-06-05 — — EP disclosed
CN-116350613-B Application of BMS-303141 in preparation of medicine for resisting gram-positive bacterial infection 华中科技大学协和深圳医院 2024-03-15 — — CN disclosed
CN-117677398-A Medicine for treating and/or preventing cancer 东丽株式会社 2024-03-08 — — CN disclosed
CN-116350613-A Application of BMS-303141 in preparation of medicine for resisting gram-positive bacterial infection 华中科技大学协和深圳医院 2023-06-30 — — CN disclosed
WO-2023008462-A1 MEDICAMENT FOR TREATMENT AND/OR PREVENTION OF CANCER 東レ株式会社 2023-02-02 — — WO disclosed
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