SCHEMBL27382549

SCHEMBL27382549

CC(O)(CF)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ POLB P06746 2/20 0.56
▸ LMNA P02545 1/20 0.55
▸ PTPN1 P18031 2/20 0.54
▸ CACNA1B Q00975 1/20 0.53
▸ APBA1 Q02410 1/20 0.53
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ HDAC2 Q92769 2/20 0.51
▸ HDAC8 Q9BY41 2/20 0.51
▸ HDAC6 Q9UBN7 2/20 0.51
▸ SIRT1 Q96EB6 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ PDK1 Q15118 4/20 0.51
▸ PDK2 Q15119 4/20 0.51
▸ PDK3 Q15120 4/20 0.51
▸ PDK4 Q16654 4/20 0.51
▸ ABCC9 O60706 2/20 0.51
▸ ABCC8 Q09428 2/20 0.51

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
SCHEMBL14086869 0.89 PDK1 (0.62) MEN1KMT2APOLBRAB9AHDAC2
SCHEMBL14086870 0.89 PDK1 (0.62) MEN1KMT2APOLBRAB9AHDAC2
SCHEMBL8866262 0.87 ABCC9 (0.68) MEN1KMT2ALMNANPC1RAB9A
SCHEMBL8865957 0.79 ABCC9 (0.69) MEN1KMT2AABCC9ABCC8KCNJ11
SCHEMBL14715847 0.78 PTPN1 (0.84) MEN1KMT2APOLBPTPN1CACNA1B
SCHEMBL8321463 0.76 PDK1 (0.61) MEN1KMT2ALMNARAB9AHDAC2
SCHEMBL11124245 0.76 MEN1 (0.83) MEN1KMT2APOLBPTPN1CACNA1B
SCHEMBL30994891 0.76 KCNK9 (0.72) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL26953087 0.76 PTPN1 (0.88) MEN1KMT2APOLBPTPN1CACNA1B
SCHEMBL1315526 0.76 PTPN1 (0.87) MEN1KMT2APOLBPTPN1CACNA1B

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-1069727-A The acid amides that is used for the treatment of ICI PLC (GB) 1993-03-10 — — CN disclosed
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