SCHEMBL3853993

SCHEMBL3853993

C[C@@H]1c2cc(F)ccc2-c2ccccc2N1C(=O)c1ccc(O)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.38
HSD11B1 P28845 1/20 0.37
PDK1 Q15118 1/20 0.36
PDK2 Q15119 1/20 0.36
PDK3 Q15120 1/20 0.36
PDK4 Q16654 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HSP90B1 P14625 2/20 0.35
TRAP1 Q12931 2/20 0.35
SLC22A12 Q96S37 1/20 0.35
PPIA P62937 1/20 0.35

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
SCHEMBL3860324 1.00 KMT2A (0.41) KMT2AMEN1HSD11B1PDK1PDK2
SCHEMBL3856290 0.92 ESR1 (0.39) KMT2AMEN1HSD11B1TSHRL3MBTL1
SCHEMBL3860298 0.89 KMT2A (0.41) KMT2AMEN1TSHRL3MBTL1HSP90B1
SCHEMBL3860727 0.89 KMT2A (0.41) KMT2AMEN1TSHRL3MBTL1HSP90B1
SCHEMBL3861337 0.88 KMT2A (0.40) KMT2AMEN1HSD11B1PDK1PDK2
SCHEMBL3855973 0.88 KMT2A (0.40) KMT2AMEN1HSD11B1PDK1PDK2
SCHEMBL3861316 0.87 KMT2A (0.49) KMT2AMEN1TSHRL3MBTL1
SCHEMBL3854629 0.87 KMT2A (0.49) KMT2AMEN1TSHRL3MBTL1
SCHEMBL3855841 0.87 TSHR (0.45) KMT2AMEN1TSHRSLC22A12
SCHEMBL3854370 0.87 TSHR (0.45) KMT2AMEN1TSHRSLC22A12

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
US-7585871-B2 4-{[(6R)-8-fluoro-6-methylphenanthridin-5(6H)-yl]carbonyl}phenol; 3-{[(6S)-8-fluoro-6-methylphenanthridin-5(6H)-yl]carbonyl}phenol; 4-{[(6S)-8-fluoro-6-methylphenanthridin-5(6H)-yl]carbonyl}phenol; cytokine expression WYETH (US) 2009-09-08 US claimed
US-20060058337-A1 Phenanthridine carbonyl phenols WYETH (US) 2006-03-16 US claimed
US-7585871-B2 4-{[(6R)-8-fluoro-6-methylphenanthridin-5(6H)-yl]carbonyl}phenol; 3-{[(6S)-8-fluoro-6-methylphenanthridin-5(6H)-yl]carbonyl}phenol; 4-{[(6S)-8-fluoro-6-methylphenanthridin-5(6H)-yl]carbonyl}phenol; cytokine expression WYETH (US) 2009-09-08 US disclosed
US-20060058337-A1 Phenanthridine carbonyl phenols WYETH (US) 2006-03-16 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-20060058337-A1 Phenanthridine carbonyl phenols MT-CO2, PAH, CBR3 KMT2A 1282/4885MEN1 3644/4885HSD11B1 3617/4885

“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.