SCHEMBL19984873

SCHEMBL19984873

CCOC(=O)CC1CCc2ccc(C(F)(F)F)cc21

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 8/20 0.55
CYP11B2 P19099 8/20 0.55
PPARD Q03181 2/20 0.46
PPARA Q07869 2/20 0.46
NQO2 P16083 5/20 0.43
MTNR1A P48039 5/20 0.43
MTNR1B P49286 5/20 0.43
HTR2A P28223 3/20 0.40
HTR2C P28335 3/20 0.40
HTR2B P41595 3/20 0.40
FFAR1 O14842 1/20 0.40
HSD17B1 P14061 1/20 0.40

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
SCHEMBL13424132 0.82 MTNR1A (0.55) CYP11B1CYP11B2PPARDNQO2MTNR1A
SCHEMBL1470331 0.80 MTNR1A (0.60) NQO2MTNR1AMTNR1B
SCHEMBL24496045 0.79 HTR2C (0.50) CYP11B1CYP11B2PPARDPPARANQO2
SCHEMBL5641289 0.78 PPARD (0.62) PPARDPPARAFFAR1
SCHEMBL30618514 0.78 CYP1A2 (0.47) CYP11B1CYP11B2PPARDMTNR1AMTNR1B
SCHEMBL3348647 0.78 CYP1A2 (0.47) CYP11B1CYP11B2PPARDMTNR1AMTNR1B
SCHEMBL14508397 0.77 PPARD (0.40) CYP11B1CYP11B2PPARDNQO2MTNR1A
SCHEMBL7566057 0.77 CYP11B1 (0.48) CYP11B1CYP11B2NQO2MTNR1AMTNR1B
SCHEMBL23934435 0.76 HTR2C (0.48) NQO2MTNR1AMTNR1BHTR2AHTR2C
SCHEMBL8011041 0.76 MTNR1A (0.46) NQO2MTNR1AMTNR1B

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-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 3052/4885PPARD 3554/4885
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS FGF1, MST1, CDC20 CYP11B1 2334/4885CYP11B2 3052/4885PPARD 3554/4885

“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.