SCHEMBL6295545

SCHEMBL6295545

CCOC(=O)CC(C)NC(=O)c1c(I)cccc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 7/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
PPARG P37231 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 2/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
PTPRC P08575 1/20 0.35
PTPRF P10586 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPA Q15257 1/20 0.35
NLRP3 Q96P20 1/20 0.35

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
SCHEMBL550366 0.80 ALDH1A1 (0.40) MEN1KMT2AALDH1A1HSD17B10SMN1; SMN2
SCHEMBL552115 0.79 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL551877 0.79 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL2891824 0.78 MEN1 (0.42) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL6292445 0.78 EPHX2 (0.38) ALDH1A1MAPTPPARGALOX15HSD17B10
SCHEMBL4978507 0.78 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL4974939 0.78 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL20366937 0.76 THRB (0.51) MEN1KMT2AALDH1A1TSHRMAPT
SCHEMBL2918472 0.76 ATM (0.39) MEN1KMT2AALDH1A1POLBRAB9A
SCHEMBL8972504 0.75 RAB9A (0.57) MEN1KMT2AALDH1A1TSHRRAB9A

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
US-6864289-B1 Aromatic diamide derivatives or salts thereof, agricultural/horticultural chemicals and method of using the same NIHON NOHYAKU CO., LTD. (JP) 2005-03-08 US disclosed
EP-1215200-A1 AROMATIC DIAMIDE DERIVATIVES OR SALTS THEREOF, AGRICULTURAL/HORTICULTURAL CHEMICALS AND METHOD OF USING THE SAME Nihon Nohyaku Co., Ltd. (JP) 2002-06-19 EP disclosed