SCHEMBL8533470

SCHEMBL8533470

Cc1c(-c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)[nH]c2ccccc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.54
KIF11 P52732 4/20 0.47
SERPINE1 P05121 1/20 0.42
CYP2D6 P10635 2/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SCN9A Q15858 1/20 0.39
ACP1 P24666 1/20 0.39
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.38
PDE10A Q9Y233 2/20 0.38

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
SCHEMBL29505903 1.00 MAT2A (0.54) MAT2AKIF11SERPINE1CYP2D6ABCG2
SCHEMBL8515371 0.95 MAT2A (0.56) MAT2AKIF11CYP2D6ABCG2MAPT
SCHEMBL8532964 0.89 MAT2A (0.52) MAT2AKIF11CYP2D6ABCG2MAPT
SCHEMBL8537649 0.87 MAT2A (0.52) MAT2AKIF11CYP2D6MAPTKMT2A
SCHEMBL27549061 0.85 KIF11 (0.55) MAT2AKIF11MAPTKMT2ATDP1
SCHEMBL8537070 0.85 MAT2A (0.57) MAT2AKIF11CYP2D6KMT2AKDM4E
SCHEMBL19002068 0.84 KIF11 (0.46) MAT2AKIF11SERPINE1ABCG2MAPT
SCHEMBL8537912 0.84 MAT2A (0.59) MAT2AKIF11CYP2D6MAPTKMT2A
SCHEMBL8515205 0.83 SLC2A1 (0.52) KIF11SERPINE1ABCG2MAPTKMT2A
SCHEMBL24783663 0.81 MAT2A (0.49) MAT2AKIF11CYP2D6ABCG2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10799494-B2 Combination of respiratory electron transport chain inhibitors with a cytochrome bd inhibitor LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2020-10-13 US claimed
US-20190151305-A1 COMBINATION PRODUCT LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2019-05-23 US claimed
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO claimed
US-10799494-B2 Combination of respiratory electron transport chain inhibitors with a cytochrome bd inhibitor LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2020-10-13 US disclosed
US-10799494-B2 Combination of respiratory electron transport chain inhibitors with a cytochrome bd inhibitor LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2020-10-13 US disclosed
US-20190151305-A1 COMBINATION PRODUCT LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2019-05-23 US disclosed
US-20190151305-A1 COMBINATION PRODUCT LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2019-05-23 US disclosed
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO disclosed
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10799494-B2 Combination of respiratory electron transport chain inhibitors with a cytochrome bd inhibitor NDUFB7, NDUFB3, NDUFB5 MAT2A 3025/4885KIF11 2588/4885SERPINE1 1231/4885
US-20190151305-A1 COMBINATION PRODUCT NDUFB5, NDUFB7, NDUFB10 MAT2A 2903/4885KIF11 1969/4885SERPINE1 1281/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.