SCHEMBL19213003

SCHEMBL19213003

C=C(Oc1ccc(Cl)cc1F)C(=O)c1ccccc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.63
CYP11B2 P19099 1/20 0.63
CYP1A2 P05177 1/20 0.50
PPARG P37231 3/20 0.45
PPARA Q07869 3/20 0.45
CES2 O00748 2/20 0.45
CES1 P23141 2/20 0.45
RECQL P46063 1/20 0.41
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MRGPRX4 Q96LA9 3/20 0.39
PNLIP P16233 2/20 0.39
USP30 Q70CQ3 1/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 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
SCHEMBL19213005 0.84 CYP11B1 (0.67) CYP11B1CYP11B2CYP1A2CES2CES1
SCHEMBL30634450 0.78 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL17714145 0.78 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL17714147 0.78 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL17723906 0.78 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL19212998 0.77 CYP11B1 (0.58) CYP11B1CYP11B2CES2CES1RECQL
SCHEMBL9730220 0.72 PPARG (0.57) CYP11B1CYP11B2CYP1A2PPARGPPARA
SCHEMBL19212999 0.71 CYP11B1 (0.60) CYP11B1CYP11B2PPARGPPARACES2
SCHEMBL19212936 0.71 CYP11B1 (0.60) CYP11B1CYP11B2PPARGPPARACES2
SCHEMBL18115522 0.70 PPARG (0.50) CYP11B1CYP11B2PPARGPPARAKMT2A

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 32/4885CYP1A2 9/4885

“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.