SCHEMBL30774047

SCHEMBL30774047

CCn1c(CNC(=O)c2ccc(Cl)cc2)nnc1SCC(=O)Nc1ccc(Br)c(C)c1C

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.59
▸ THRB P10828 1/20 0.58
▸ PTGES O14684 1/20 0.57
▸ ATM Q13315 1/20 0.57
▸ ALDH1A1 P00352 4/20 0.55
▸ GAA P10253 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ TSHR P16473 1/20 0.50
▸ HTT P42858 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ HPGD P15428 1/20 0.49

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
SCHEMBL1898835 1.00 LMNA (0.59) LMNATHRBPTGESATMALDH1A1
SCHEMBL15835213 0.86 SLC27A1 (0.48) LMNATHRBPTGESATMALDH1A1
SCHEMBL14970840 0.74 TP53 (0.71) THRBPTGESALDH1A1TP53SMN1; SMN2
SCHEMBL18559341 0.72 ATM (1.00) LMNATHRBPTGESATMALDH1A1
SCHEMBL14970814 0.72 SMN1; SMN2 (0.71) LMNATHRBPTGESATMALDH1A1
SCHEMBL18559152 0.72 GAA (0.84) LMNAATMALDH1A1GAATP53
SCHEMBL18559258 0.71 ALDH1A1 (1.00) THRBPTGESATMALDH1A1GAA
SCHEMBL29327531 0.70 ALDH1A1 (0.60) PTGESATMALDH1A1GAATP53
SCHEMBL14970841 0.69 THRB (0.68) LMNATHRBPTGESATMALDH1A1
SCHEMBL4209247 0.69 ALDH1A1 (0.68) LMNAPTGESALDH1A1GAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024037910-A1 SYK INHIBITORS FOR USE IN THE TREATMENT OF CANCER Institut National de la Santé et de la Recherche Médicale (FR) 2024-02-22 — — WO disclosed
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