SCHEMBL25431445

SCHEMBL25431445

CCN(CC)c1ccc2cc(-c3cc(=O)[nH]c(NC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)O)n3)c(=O)oc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.40
▸ MEN1 O00255 8/20 0.40
▸ KMT2A Q03164 8/20 0.40
▸ USP2 O75604 5/20 0.40
▸ LMNA P02545 5/20 0.40
▸ ATM Q13315 5/20 0.40
▸ CYP19A1 P11511 4/20 0.40
▸ HTT P42858 4/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ RAB9A P51151 4/20 0.40
▸ TP53 P04637 2/20 0.40
▸ CASP1 P29466 2/20 0.40
▸ CASP7 P55210 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ BRCA1 P38398 1/20 0.40
▸ HBB P68871 1/20 0.40
▸ PTK2B Q14289 1/20 0.40
▸ ALDH1A1 P00352 6/20 0.39
▸ KDM4E B2RXH2 5/20 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
SCHEMBL25431450 1.00 MAPT (0.40) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL25429462 0.89 MAP1LC3B (0.37) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL25430751 0.87 MAP1LC3B (0.36) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL25430909 0.86 CYP19A1 (0.36) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL25333492 0.85 CYP19A1 (0.46) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL25333502 0.85 CYP19A1 (0.46) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL21806091 0.80 ALDH1A1 (0.52) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL25336517 0.79 CYP19A1 (0.39) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL22386529 0.78 MAPT (0.43) MAPTMEN1KMT2AUSP2LMNA
SCHEMBL25334968 0.77 CYP19A1 (0.38) MAPTMEN1KMT2AUSP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023148785-A1 FLUORESCENT AND SELF-ASSEMBLING UREIDOPYRIMIDINONE CONJUGATES AND PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2023-08-10 — — WO claimed
WO-2023148785-A1 FLUORESCENT AND SELF-ASSEMBLING UREIDOPYRIMIDINONE CONJUGATES AND PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2023-08-10 — — WO disclosed
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