SCHEMBL3854629

SCHEMBL3854629

C[C@@H]1c2cc(F)ccc2-c2ccccc2N1C(=O)c1ccc(O)cc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
POLB P06746 1/20 0.41
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
HCRTR2 O43614 1/20 0.36
TSHR P16473 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL3861316 1.00 KMT2A (0.49) KMT2AMEN1POLBCRHBPCRHR2
SCHEMBL3858498 0.91 KMT2A (0.43) KMT2AMEN1POLBHCRTR2TSHR
SCHEMBL3856014 0.91 KMT2A (0.43) KMT2AMEN1POLBHCRTR2TSHR
SCHEMBL3858289 0.91 KMT2A (0.43) KMT2AMEN1POLBHCRTR2TSHR
SCHEMBL3855998 0.91 KMT2A (0.46) KMT2AMEN1POLB
SCHEMBL3860354 0.91 KMT2A (0.46) KMT2AMEN1POLB
SCHEMBL3855449 0.91 KMT2A (0.46) KMT2AMEN1POLB
SCHEMBL3860943 0.88 KMT2A (0.46) KMT2AMEN1POLB
SCHEMBL3863242 0.88 KMT2A (0.46) KMT2AMEN1POLB
SCHEMBL3853993 0.87 KMT2A (0.41) KMT2AMEN1TSHRL3MBTL1

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 3644/4885POLB 1351/4885

“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.