SCHEMBL27700360

SCHEMBL27700360

CC(C)(C)NC(=O)OCc1ccc(OC=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
MIF P14174 1/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPT P10636 2/20 0.39
ATM Q13315 1/20 0.39
ITGB3 P05106 3/20 0.38
ITGA2B P08514 3/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
TOP2A P11388 1/20 0.37
TOP2B Q02880 1/20 0.37
NAAA Q02083 1/20 0.37
CTSS P25774 1/20 0.37
NR2F2 P24468 1/20 0.36

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
SCHEMBL25754099 0.83 ALDH1A1 (0.61) ALDH1A1MIFMEN1KMT2ASMN1; SMN2
SCHEMBL22108005 0.82 ALDH1A1 (0.46) ALDH1A1MIFMEN1KMT2ASMN1; SMN2
SCHEMBL27691284 0.82 ADRB2 (0.44) ALDH1A1MIFMEN1KMT2ASMN1; SMN2
SCHEMBL27571682 0.81 TSHR (0.51) ALDH1A1MIFMEN1KMT2ASMN1; SMN2
SCHEMBL28861927 0.80 NPC1 (0.51) ALDH1A1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL27811154 0.80 SMN1; SMN2 (0.44) ALDH1A1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL16590551 0.79 MAPT (0.44) ALDH1A1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL2173527 0.78 MEN1 (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL4019989 0.78 TPSAB1 (0.54) ALDH1A1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL28861926 0.78 MAPT (0.56) ALDH1A1MEN1KMT2ASMN1; SMN2L3MBTL1

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-108473550-A EGF (A) analogues with fatty acid substituents 诺和诺德股份有限公司 2018-08-31 CN disclosed
CN-101056639-A Thiazolopyridine kinase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2007-10-17 CN disclosed