SCHEMBL29362116

SCHEMBL29362116

COc1cc(N(C)C)cc(CN(C)CCc2ccc([N+](=O)[O-])cc2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CDC25C P30307 5/20 1.00
▸ MEN1 O00255 1/20 0.80
▸ THRB P10828 1/20 0.80
▸ APEX1 P27695 1/20 0.80
▸ RECQL P46063 1/20 0.80
▸ BLM P54132 1/20 0.80
▸ KMT2A Q03164 1/20 0.80
▸ TDP1 Q9NUW8 1/20 0.80
▸ KCNH2 Q12809 5/20 0.48
▸ SIGMAR1 Q99720 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ ACHE P22303 1/20 0.40
▸ KCNJ1 P48048 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ HTR2A P28223 1/20 0.39

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
SCHEMBL1917644 0.89 MEN1 (1.00) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL29369543 0.89 MEN1 (1.00) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL4247040 0.84 MEN1 (0.75) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL1916880 0.78 CDC25C (1.00) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL6080522 0.78 MEN1 (0.68) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL6434785 0.76 CDC25C (0.61) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL3153190 0.76 CDC25C (0.67) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL3158326 0.75 CDC25C (0.65) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL3143117 0.74 KCNH2 (0.64) CDC25CMEN1THRBAPEX1RECQL
SCHEMBL1917318 0.74 CDC25C (1.00) CDC25CMEN1THRBAPEX1RECQL

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
CN-119700983-A Application of UBR5 in preparation of medicines for treating pigment dermatosis 中南大学湘雅医院 2025-03-28 — — CN claimed
CN-119700983-A Application of UBR5 in preparation of medicines for treating pigment dermatosis 中南大学湘雅医院 2025-03-28 — — CN disclosed
US-20240110230-A1 BIOMARKERS FOR CANCER TREATMENT FOUNDATION MEDICINE, INC. (US) 2024-04-04 — — US disclosed
EP-4291902-A2 BIOMARKERS FOR CANCER TREATMENT Foundation Medicine, Inc. (US) 2023-12-20 — — EP disclosed
WO-2022174234-A2 BIOMARKERS FOR CANCER TREATMENT FOUNDATION MEDICINE, INC. (US) 2022-08-18 — — WO disclosed
WO-2022018667-A1 COMBINATION THERAPIES USING CDK2 AND CDC25A INHIBITORS PFIZER INC. (US) 2022-01-27 — — WO disclosed
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