SCHEMBL4451884

SCHEMBL4451884

Cc1c(F)cccc1C([O])=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.53
ESR2 Q92731 1/20 0.53
CES2 O00748 4/20 0.48
CES1 P23141 4/20 0.48
BCHE P06276 1/20 0.48
ALB P02768 1/20 0.45
GAA P10253 1/20 0.44
ALDH1A1 P00352 1/20 0.43
ALOX15 P16050 1/20 0.43
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
HDAC4 P56524 1/20 0.40
KMT2A Q03164 2/20 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
SCHEMBL11476967 0.83 ESR1 (0.53) ESR1ESR2CES2CES1BCHE
SCHEMBL17040388 0.83 ESR1 (0.53) ESR1ESR2CES2CES1BCHE
SCHEMBL504015 0.83 ALB (0.61) ESR1ESR2CES2CES1BCHE
SCHEMBL29570483 0.83 ALB (0.61) ESR1ESR2CES2CES1BCHE
SCHEMBL3442002 0.81 ALDH1A1 (0.63) ESR1ESR2CES2CES1BCHE
SCHEMBL9539463 0.81 ESR1 (0.51) ESR1ESR2CES2CES1BCHE
SCHEMBL2468641 0.81 ESR1 (0.51) ESR1ESR2CES2CES1BCHE
Hydrochloric Acid SCHEMBL27873130 0.79 ESR1 (0.50) ESR1ESR2CES2CES1BCHE
SCHEMBL5248806 0.79 TSHR (0.63) ESR1ESR2GAAALDH1A1ALOX15
SCHEMBL30353807 0.78 LMNA (0.50) ESR1ESR2GAAALDH1A1SLC6A4

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
US-7629494-B2 Process for producing cyclopropylphenol derivative MITSUI CHEMICALS AGRO, INC. (JP) 2009-12-08 US disclosed
US-20090054681-A1 Production Process of cyclopropylphenol derivatives SANKYO AGRO COMPANY, LIMITED (JP) 2009-02-26 US disclosed
EP-1880987-A1 PROCESS FOR PRODUCING CYCLOPROPYLPHENOL DERIVATIVE Sankyo Agro Company, Limited (JP) 2008-01-23 EP 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 (1 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-20090054681-A1 Production Process of cyclopropylphenol derivatives CBR3, CYP4X1, CYP4A11 ESR1 1620/4885ESR2 1931/4885CES2 993/4885

“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.