SCHEMBL27655779

SCHEMBL27655779

CCc1c(O)cc(O)c(C(=O)c2ccc(OC)cc2)c1CC(=O)N1CCN(c2ccccc2)C(C=O)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 2/20 0.38
RAB9A P51151 1/20 0.38
GPR183 P32249 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 2/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
GFER P55789 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
HIF1A Q16665 1/20 0.34
USP2 O75604 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
SCHEMBL27655782 0.92 MAPT (0.41) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL27655745 0.90 LMNA (0.35) ALDH1A1KMT2ALMNARAB9ASMN1; SMN2
SCHEMBL15225754 0.84 MAPK1 (0.50) ALDH1A1KMT2AMEN1LMNASMN1; SMN2
SCHEMBL2863214 0.80 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1LMNAGPR183
SCHEMBL27655750 0.80 GRM1 (0.38) ALDH1A1LMNAKDM4ETHRBHIF1A
SCHEMBL2864940 0.80 MAPT (0.48) ALDH1A1KMT2ALMNAMAPTMAPK1
SCHEMBL2866292 0.80 GRM3 (0.42) ALDH1A1LMNARAB9ASMN1; SMN2POLB
SCHEMBL2858385 0.79 MAPT (0.55) ALDH1A1KMT2AMEN1SMN1; SMN2POLB
SCHEMBL2856092 0.79 SMN1; SMN2 (0.47) ALDH1A1KMT2AMEN1LMNASMN1; SMN2
SCHEMBL2865742 0.78 GRM3 (0.49) ALDH1A1LMNARAB9ASMN1; SMN2KDM4E

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-100567242-C Hsp90 family protein blockers KYOWA HAKKO KOGYO KK (JP) 2009-12-09 CN disclosed
CN-1791568-A Hsp90 family protein inhibitors KYOWA HAKKO KOGYO KK (JP) 2006-06-21 CN disclosed