SCHEMBL7929970

SCHEMBL7929970

Oc1c(I)cc(I)cc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.56
ERN1 O75460 1/20 0.42
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRB2 P47870 1/20 0.32
ALB P02768 1/20 0.32
CFTR P13569 1/20 0.32
CHEK1 O14757 1/20 0.31
DAPK3 O43293 1/20 0.31
RET P07949 1/20 0.31
PDGFRB P09619 1/20 0.31
PIM1 P11309 1/20 0.31
PDGFRA P16234 1/20 0.31
KDR P35968 1/20 0.31
MAPK8 P45983 1/20 0.31
RPS6KA3 P51812 1/20 0.31

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
SCHEMBL29314372 0.80 CES2 (0.38) TTRALBCFTRCHEK1DAPK3
SCHEMBL813690 0.80 TTR (0.37) TTRALBCFTRCHEK1DAPK3
SCHEMBL30206853 0.80 TTR (0.37) TTRALBCFTRCHEK1DAPK3
SCHEMBL896605 0.78 CA1 (0.38) TTRHIF1AHSD17B10GABRA1GABRB1
SCHEMBL15757953 0.78 CHEK1 (0.37) TTRGABRA1GABRB1GABRB2ALB
SCHEMBL29611781 0.78 CHEK1 (0.37) TTRGABRA1GABRB1GABRB2ALB
SCHEMBL350953 0.77 TTR (0.64) TTRERN1CYP1A2CYP2C9HIF1A
SCHEMBL28104789 0.75 CYP2C9 (0.37) TTRCYP2C9CFTRMEN1LMNA
Triiodophenol SCHEMBL338137 0.74 TTR (1.00) TTRERN1CYP1A2CYP2C9HIF1A
SCHEMBL13191049 0.72 TTR (0.56) TTRERN1CYP1A2CYP2C9HIF1A

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-0707849-A1 USE OF DERIVATIVES OF 2,4-BISUBSTITUTED PHENOLS AS 5-LIPOXIGENASE INHIBITORS BOBEL246 S.L. (ES) 1996-04-24 EP claimed
EP-0707849-B1 USE OF DERIVATIVES OF 2,4-DISUBSTITUTED PHENOLS AS 5-LIPOXIGENASE INHIBITORS BOBEL246 S L (ES) 2001-12-19 EP disclosed
EP-0707849-A1 USE OF DERIVATIVES OF 2,4-BISUBSTITUTED PHENOLS AS 5-LIPOXIGENASE INHIBITORS BOBEL246 S.L. (ES) 1996-04-24 EP disclosed