SCHEMBL5085698

SCHEMBL5085698

C=C(CCc1c(Br)cc(Br)cc1Br)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR17 Q13304 4/20 0.41
AKR1C4 P17516 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
AKR1C1 Q04828 1/20 0.36
HSD17B10 Q99714 1/20 0.33
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
FBP1 P09467 1/20 0.31
GPR35 Q9HC97 1/20 0.30

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
SCHEMBL6047051 0.81 AKR1C4 (0.38) GPR17AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL5586405 0.74 THRB (0.42) HSD17B10CYP3A4TDP1
SCHEMBL449703 0.73 THRA (0.44) HSD17B10CYP3A4TDP1
SCHEMBL1920376 0.72 FFAR1 (0.50)
SCHEMBL1989802 0.70 KDM4E (0.46) HSD17B10TDP1GPR35
SCHEMBL22653561 0.70 TDP1 (0.45) GPR17AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL7074081 0.69 HSD17B10 (0.40) HSD17B10
SCHEMBL8897387 0.69 AKR1B1 (0.43) AKR1C4AKR1C3AKR1C2AKR1C1HSD17B10
SCHEMBL10890555 0.68 TET2 (0.31) HSD17B10
SCHEMBL5266797 0.68 TET2 (0.31) HSD17B10TSHR

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
EP-0441383-B1 Use of a copolymer for the making of contact lenses MITSUBISHI RAYON CO (JP) 1996-05-08 EP claimed
EP-4224244-A1 EYEGLASS LENS Hoya Lens Thailand Ltd. (TH) 2023-08-09 EP disclosed
EP-4224245-A1 SPECTACLE LENS Hoya Lens Thailand Ltd. (TH) 2023-08-09 EP disclosed
US-20230176250-A1 SPECTACLE LENS HOYA LENS THAILAND LTD. (TH) 2023-06-08 US disclosed
US-20230111587-A1 SPECTACLE LENS HOYA LENS THAILAND LTD. (TH) 2023-04-13 US disclosed
US-20080145545-A1 METAL OXIDE AND SULFUR-CONTAINING COATING COMPOSITIONS, METHODS OF USE, AND ARTICLES PREPARED THEREFROM CITIBANK, N.A., AS COLLATERAL AGENT 2008-06-19 US disclosed