SCHEMBL19984879

SCHEMBL19984879

CCOC(=O)CC1CCc2c1cccc2C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.56
CYP11B2 P19099 3/20 0.56
FFAR1 O14842 5/20 0.47
CMA1 P23946 3/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NOD2 Q9HC29 1/20 0.40
NOD1 Q9Y239 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CYP1A2 P05177 1/20 0.38
CACNA1C Q13936 1/20 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
SCHEMBL19985032 0.83 CYP11B1 (0.45) CYP11B1CYP11B2FFAR1ALDH1A1GAA
SCHEMBL12798477 0.83 ESR1 (0.51) CYP11B1CYP11B2CYP1A2
SCHEMBL26308105 0.81 FFAR1 (0.44) CYP11B1CYP11B2FFAR1KDM4EALDH1A1
SCHEMBL1338586 0.81 FFAR1 (0.44) CYP11B1CYP11B2FFAR1KDM4EALDH1A1
SCHEMBL1339687 0.79 CYP11B1 (0.51) CYP11B1CYP11B2FFAR1ALDH1A1CYP1A2
SCHEMBL30618514 0.75 CYP1A2 (0.47) CYP11B1CYP11B2FFAR1ALDH1A1CYP1A2
SCHEMBL3348647 0.75 CYP1A2 (0.47) CYP11B1CYP11B2FFAR1ALDH1A1CYP1A2
SCHEMBL19985033 0.74 FFAR1 (0.44) FFAR1CMA1KDM4EALDH1A1GAA
SCHEMBL30852256 0.74 RBP4 (0.48) KDM4EALDH1A1GAAMAPK1KMT2A
SCHEMBL12086776 0.73 SIGMAR1 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512843-B1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-10-20 EP disclosed
US-11136292-B2 Plant growth regulator compounds SYNGENTA PARTICIPATIONS AG (CH) 2021-10-05 US disclosed
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-10-31 US disclosed
WO-2018050477-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 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-11136292-B2 Plant growth regulator compounds FGF1, MST1, CDC20 CYP11B1 2334/4885CYP11B2 3052/4885FFAR1 2309/4885
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS FGF1, MST1, CDC20 CYP11B1 2334/4885CYP11B2 3052/4885FFAR1 2309/4885

“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.