SCHEMBL29274141

SCHEMBL29274141

CCCN(C=O)c1ccccc1Nc1c(C(C)C)cccc1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL30657017 0.85 NR3C1 (0.39) LMNAKMT2A
SCHEMBL29274122 0.85 NR3C1 (0.39) LMNAKMT2A
SCHEMBL29274130 0.77 MAPT (0.38) LMNAKMT2AMAPK1
SCHEMBL23106359 0.75 KDM1A (0.51) LPAR1LMNAKMT2ASMN1; SMN2POLB
SCHEMBL29274137 0.75 ALDH1A1 (0.33) LMNASMN1; SMN2POLBMAPK1
SCHEMBL6744857 0.73 LMNA (0.47) LPAR1LMNAKMT2ASMN1; SMN2POLB
SCHEMBL31447156 0.73 LMNA (0.47) LPAR1LMNAKMT2ASMN1; SMN2POLB
SCHEMBL23106338 0.72 LPAR1 (0.38) LPAR1LMNAKMT2ASMN1; SMN2POLB
SCHEMBL29274133 0.72 MEN1 (0.50) KMT2ASMN1; SMN2
SCHEMBL6131394 0.71 LMNA (0.41) LPAR1LMNAKMT2ASMN1; SMN2POLB

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
CN-117069747-A Method for synthesizing N-heterocyclic carbene complex by utilizing hydrolysate of imidazole salt 石河子大学 2023-11-17 CN claimed
CN-117069747-A Method for synthesizing N-heterocyclic carbene complex by utilizing hydrolysate of imidazole salt 石河子大学 2023-11-17 CN disclosed