SCHEMBL7943776

SCHEMBL7943776

CCOC(=O)c1cc2c(C(F)(F)F)cccc2n1C(N)CCC(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CCR2 P41597 1/20 0.34
F10 P00742 1/20 0.34
ALOX5 P09917 1/20 0.34
HSD17B10 Q99714 2/20 0.33
USP2 O75604 1/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
RECQL P46063 1/20 0.33
AR P10275 1/20 0.32
MAPT P10636 1/20 0.32
HIF1A Q16665 1/20 0.32
TSHR P16473 2/20 0.32
LDHA P00338 1/20 0.32
ALDH1A1 P00352 2/20 0.32
SLC5A1 P13866 1/20 0.32
SLC5A2 P31639 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL7943774 0.79 F10 (0.40) KDM4EL3MBTL1CCR2F10ALOX5
SCHEMBL27363674 0.74 ALOX5 (0.48) KDM4ECCR2F10ALOX5HSD17B10
SCHEMBL27320352 0.72 MTNR1A (0.41)
SCHEMBL7881461 0.70 CNR2 (0.46) KDM4ECCR2F10TSHRALDH1A1
SCHEMBL7957934 0.69 F10 (0.53) KDM4EL3MBTL1F10HSD17B10RECQL
SCHEMBL7683902 0.69 CCR2 (0.55) KDM4ECCR2LDHAALDH1A1
SCHEMBL7873244 0.67 KMT2A (0.46) KDM4EL3MBTL1CCR2F10ALOX5
SCHEMBL6798270 0.66 PSEN1 (0.43) KDM4EL3MBTL1ALOX5HSD17B10MAPT
SCHEMBL27430450 0.66 KDM4E (0.37) KDM4EL3MBTL1ALOX5HSD17B10AR
SCHEMBL6306892 0.65 CCR2 (0.74) KDM4ECCR2F10MAPK1MAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1067988-C Indoloylguanidine derivatives SUMITOMO PHARMACEUTICS K K (JP) 2001-07-04 CN disclosed
US-6248772-B1 HYPOTENSIVE AGENTS; ANTIARRHYTHMIA AGENTS; ANTIDIABETIC AGENTS; ANTIPROLIFERATIVE AGENTS SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2001-06-19 US disclosed
CN-1051301-C Indoloylguanidine derivatives SUMITOMO PHARMA (JP) 2000-04-12 CN disclosed
CN-1136038-A Indoloylguanidine derivatives SUMITOMO PHARMACEUTICS K K (JP) 1996-11-20 CN disclosed
EP-0708091-A2 Indoloylguanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-04-24 EP disclosed
CN-1106800-A Indoloylguanidine derivatives SUMITOMO PHARMA (JP) 1995-08-16 CN disclosed