SCHEMBL20516073

SCHEMBL20516073

COc1c(C(=O)O)ccc(F)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
MAPT P10636 1/20 0.46
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 2/20 0.44
APEX1 P27695 2/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
ADRA2A P08913 1/20 0.39
CLCN2 P51788 1/20 0.39
ACLY P53396 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 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
SCHEMBL6828217 0.86 TDP1 (0.46) TDP1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL18529850 0.85 TDP1 (0.52) TDP1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL6215307 0.83 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL12756987 0.81 TDP1 (0.49) TDP1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL1893739 0.81 ALDH1A1 (0.56) TDP1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL1261447 0.81 HMGCR (0.39) ALDH1A1KDM4EHSD17B10TSHRSMN1; SMN2
SCHEMBL18700959 0.81 GAA (0.42) MAPTALDH1A1KDM4EHSD17B10MRGPRX4
SCHEMBL23213504 0.80 TDP1 (0.47) TDP1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL29947795 0.80 TDP1 (0.47) TDP1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL288168 0.80 TDP1 (0.47) TDP1MAPTALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10365262-B2 Method of monitoring a parameter of a hydrocarbon well, pipeline or formation JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-07-30 US disclosed
US-20180284096-A1 METHOD OF MONITORING A PARAMETER OF A HYDROCARBON WELL, PIPELINE OR FORMATION TRACERCO LIMITED (GB) 2018-10-04 US disclosed