SCHEMBL19212935

SCHEMBL19212935

C=C(Oc1ccc(Cl)cc1)C(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 7/20 0.64
CYP11B2 P19099 7/20 0.64
CES2 O00748 2/20 0.51
CES1 P23141 2/20 0.51
ENPP3 O14638 1/20 0.46
ENPP1 P22413 1/20 0.46
ENPP2 Q13822 1/20 0.46
KIF11 P52732 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
PRSS1 P07477 1/20 0.44
ACR P10323 1/20 0.44
ELANE P08246 1/20 0.43
RHOC P08134 1/20 0.43
RHOA P61586 1/20 0.43
GRM4 Q14833 1/20 0.42
HPGD P15428 1/20 0.41
MGLL Q99685 1/20 0.41

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
SCHEMBL19212992 0.87 CES2 (0.56) CYP11B1CYP11B2CES2CES1ELANE
SCHEMBL19212944 0.81 HPGD (0.64) CYP11B1CYP11B2CES2CES1ELANE
SCHEMBL19212971 0.81 CYP11B1 (0.68) CYP11B1CYP11B2CES2CES1KIF11
SCHEMBL19212951 0.80 CYP11B1 (0.66) CYP11B1CYP11B2CES2PPARGPPARA
SCHEMBL19212975 0.80 CYP11B1 (0.66) CYP11B1CYP11B2CES2KIF11PPARG
SCHEMBL15392605 0.80 CES2 (0.60) CYP11B1CYP11B2CES2CES1ENPP3
SCHEMBL8669129 0.80 CES2 (0.58) CYP11B1CYP11B2CES2CES1ELANE
SCHEMBL17714184 0.78 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL19212932 0.78 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL17714182 0.78 CYP11B1 (1.00) CYP11B1CYP11B2

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
EP-3212636-B1 NEW PYRIDINYLOXY- AND PHENYLOXY-PYRAZOLYL COMPOUNDS HOFFMANN LA ROCHE (CH) 2023-11-29 EP disclosed
US-9790217-B2 Pyridinyloxy- and phenyloxy-pyrazolyl compounds HOFFMANN-LA ROCHE INC. (US) 2017-10-17 US disclosed
US-20170226097-A1 PYRIDINYLOXY- AND PHENYLOXY-PYRAZOLYL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2017-08-10 US 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-20170226097-A1 PYRIDINYLOXY- AND PHENYLOXY-PYRAZOLYL COMPOUNDS PDXK, PNPO, PAH CYP11B1 84/4885CYP11B2 32/4885CES2 1748/4885

“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.