SCHEMBL31228792

SCHEMBL31228792

NC(=O)c1ccc(F)c(Br)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.41
DGAT1 O75907 1/20 0.40
PTPN1 P18031 1/20 0.39
GRM2 Q14416 9/20 0.39
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.36
APP P05067 2/20 0.36
NNMT P40261 1/20 0.36
SCN9A Q15858 1/20 0.35
CA5A P35218 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
SCHEMBL16505348 1.00 PIM1 (0.41) PIM1DGAT1PTPN1GRM2KMT2A
SCHEMBL30601029 0.82 KDM4E (0.46) KMT2ALMNA
SCHEMBL319252 0.82 KDM4E (0.46) KMT2ALMNA
SCHEMBL13362749 0.78 PIM1 (0.50) PIM1PTPN1GRM2KMT2ALMNA
SCHEMBL16751982 0.76 APP (0.42) PIM1DGAT1PTPN1GRM2KMT2A
SCHEMBL31507586 0.76 PIM1 (0.41) PIM1DGAT1PTPN1GRM2KMT2A
SCHEMBL29502454 0.76 TGFBR1 (0.42) PIM1GRM2KMT2ALMNAAPP
SCHEMBL26684509 0.76 PIM1 (0.41) PIM1DGAT1PTPN1GRM2KMT2A
SCHEMBL2827339 0.76 TGFBR1 (0.42) PIM1GRM2KMT2ALMNAAPP
SCHEMBL11347729 0.76 KMT2A (0.39) PIM1PTPN1GRM2KMT2ALMNA

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
CN-115697991-B Piperazine cyclic ureas 维泰瑞隆有限公司 2024-11-22 CN disclosed