SCHEMBL6237544

SCHEMBL6237544

C=Cc1c([O])cccc1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 3/20 0.44
ALDH1A1 P00352 2/20 0.44
CFTR P13569 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA5A P35218 1/20 0.44
KDM4E B2RXH2 3/20 0.43
ATM Q13315 2/20 0.43
POLB P06746 2/20 0.43
KMT2A Q03164 3/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.40
ALOX15 P16050 1/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40

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
SCHEMBL22481046 0.89 TSHR (0.52) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL5047779 0.83 LMNA (0.46) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL16953271 0.83 LMNA (0.46) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL7869865 0.83 NR4A2 (0.46) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL26162753 0.83 KDM4E (0.47) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL16953273 0.81 KDM4E (0.48) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL16955450 0.80 LMNA (0.43) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL16951491 0.79 LMNA (0.42) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL31568415 0.79 ALDH1A1 (0.45) LMNATSHRHSD17B10ALDH1A1CFTR
SCHEMBL16955453 0.79 ALDH1A1 (0.45) LMNATSHRHSD17B10ALDH1A1CFTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1063252-B1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KK (JP) 2005-06-08 EP disclosed
US-6632891-B1 Obtained by an ester exchange reaction between the flame retardant phosphazene and the polycarbonate or polyester resin OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2003-10-14 US disclosed
EP-1063252-A1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2000-12-27 EP disclosed