SCHEMBL5409043

SCHEMBL5409043

OCCn1nc(-c2ccccc2)c2cc(F)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.48
HSD17B10 Q99714 2/20 0.48
KDM4E B2RXH2 2/20 0.48
TSHR P16473 1/20 0.48
MAPT P10636 4/20 0.44
ESR1 P03372 2/20 0.43
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.40
PDE5A O76074 1/20 0.40
ALOX15 P16050 1/20 0.40
KDM4C Q9H3R0 2/20 0.39
MAP2K4 P45985 1/20 0.39
ACHE P22303 1/20 0.39
BACE1 P56817 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL4033183 0.88 ESR1 (0.51) PTGER1HSD17B10KDM4ETSHRESR1
SCHEMBL5412777 0.83 KMT2A (0.48) PTGER1HSD17B10KDM4ETSHRMAPT
SCHEMBL19261470 0.83 MAPT (0.47) PTGER1HSD17B10KDM4ETSHRMAPT
SCHEMBL4034001 0.78 L3MBTL1 (0.59) PTGER1KDM4EALDH1A1HTTKMT2A
SCHEMBL4033560 0.77 ESR1 (0.54) ESR1KMT2APOLB
SCHEMBL15631882 0.77 MAPT (0.75) PTGER1HSD17B10KDM4ETSHRMAPT
SCHEMBL11843597 0.76 NPSR1 (0.45) PTGER1HSD17B10KDM4EMAPTALDH1A1
SCHEMBL5400293 0.75 MAPT (0.50) HSD17B10KDM4ETSHRMAPTESR1
SCHEMBL5401020 0.74 ESR1 (0.58) HSD17B10KDM4ETSHRMAPTESR1
SCHEMBL4027878 0.72 ESR1 (0.63) HSD17B10KDM4ETSHRMAPTESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241791-B2 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2007-07-10 US disclosed