SCHEMBL5215862

SCHEMBL5215862

CCc1c(-c2ccc(OC(C)=O)cc2)nn(-c2ccccc2C(F)(F)F)c1-c1ccc(OC(C)=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
FAAH O00519 1/20 0.36
DRD3 P35462 1/20 0.36
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CNR1 P21554 2/20 0.35
PTGS2 P35354 1/20 0.35
SLC16A3 O15427 1/20 0.35
SLC16A1 P53985 1/20 0.35
SCN9A Q15858 1/20 0.34
CNR2 P34972 2/20 0.34

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
SCHEMBL5218923 0.96 ESR1 (0.40) TP53MAPTFAAHDRD3SLC5A1
SCHEMBL5216038 0.96 ESR1 (0.40) TP53MAPTFAAHDRD3SLC5A1
SCHEMBL5217277 0.90 TP53 (0.38) TP53MAPTFAAHDRD3SLC5A1
SCHEMBL5221335 0.89 TP53 (0.39) TP53MAPTFAAHDRD3SLC5A1
SCHEMBL5214143 0.88 ESR1 (0.40) TP53MAPTFAAHDRD3SLC5A1
SCHEMBL5217758 0.88 ESR1 (0.40) TP53MAPTFAAHDRD3SLC5A1
SCHEMBL5216937 0.84 ESR1 (0.49) TP53MAPTMEN1KMT2ACNR1
SCHEMBL5217964 0.84 MAPT (0.43) TP53MAPTKMT2APTGS2
SCHEMBL5213605 0.84 MAPT (0.43) TP53MAPTKMT2APTGS2
SCHEMBL5222735 0.82 ESR1 (0.47) TP53MAPTMEN1KMT2APTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE39708-E1 Estrogen receptor modulators CHIRON CORPORATION (US) 2007-06-26 US disclosed
EP-1102753-B1 PYRAZOLES AS ESTROGEN RECEPTOR MODULATORS NOVARTIS VACCINES & DIAGNOSTIC (US) 2007-02-28 EP disclosed
US-6727273-B2 THERAPY FOR OSTEOPOROSIS, ANTICANCER AGENTS CHIRON CORPORATION 2004-04-27 US disclosed
US-20040077701-A1 Estrogen receptor modulators CHIRON CORPORATION (US) 2004-04-22 US disclosed
US-6291505-B1 PYRAZOLE ESTROGEN RECEPTOR AGONIST AND ANTAGONIST CHIRON CORPORATION 2001-09-18 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-20040077701-A1 Estrogen receptor modulators ESR1, ESR2, GPER1 TP53 575/4885MAPT 1269/4885FAAH 1921/4885

“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.