SCHEMBL9360728

SCHEMBL9360728

CCOC(=O)c1ccccc1C(=O)c1ccc(C)cc1C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.64
CDC25B P30305 1/20 0.58
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 4/20 0.51
HSD17B10 Q99714 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.47
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL3950051 0.85 TSHR (0.75) TSHRCDC25BMEN1KMT2AALDH1A1
SCHEMBL1107151 0.85 MEN1 (0.60) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL29668381 0.85 MEN1 (0.60) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL9379355 0.85 TSHR (0.88) TSHRCDC25BMEN1KMT2AALDH1A1
SCHEMBL31009568 0.85 TSHR (0.88) TSHRCDC25BMEN1KMT2AALDH1A1
SCHEMBL4139332 0.83 TSHR (0.66) TSHRCDC25BMEN1KMT2AALDH1A1
SCHEMBL4463486 0.83 TSHR (0.70) TSHRCDC25BMEN1KMT2AALDH1A1
SCHEMBL301748 0.80 TSHR (0.64) TSHRMEN1KMT2AALDH1A1HSD17B10
SCHEMBL11756227 0.80 MAPK13 (0.53) KMT2AALDH1A1SMN1; SMN2NPC1RAB9A
Diethyl Phthalate SCHEMBL28248408 0.80 TSHR (0.91) TSHRCDC25BMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0407808-B1 Catalyst, process for preparation of same, and process for polymerization of olefins using same SHOWA DENKO KK (JP) 1994-12-07 EP disclosed
US-5208302-A Coordination Catalysts Containing a Ketoester, Stereoregular SHOWA DENKO K.K. (JP) 1993-05-04 US disclosed
US-5049533-A Titanium, magnesium, halogen, keto-ester 7 SHOWA DENKO K.K. (JP) 1991-09-17 US disclosed
EP-0407808-A2 Catalyst, process for preparation of same, and process for polymerization of olefins using same SHOWA DENKO KABUSHIKI KAISHA (JP) 1991-01-16 EP disclosed