SCHEMBL3884547

SCHEMBL3884547

Nc1ccc(OCC(F)(F)C(F)F)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
POLB P06746 3/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KEAP1 Q14145 1/20 0.39
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 1/20 0.36
BRCA1 P38398 1/20 0.36
HBB P68871 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
CFTR P13569 1/20 0.35
CYP2C9 P11712 1/20 0.35
RECQL P46063 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 3/20 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
SCHEMBL29516441 0.82 L3MBTL1 (0.56) KDM4EKMT2AMEN1POLBRAB9A
SCHEMBL10092 0.82 L3MBTL1 (0.56) KDM4EKMT2AMEN1POLBRAB9A
SCHEMBL5049825 0.81 TAAR1 (0.38) KMT2APOLBL3MBTL1MAPK1CFTR
Hydrochloric Acid SCHEMBL1496776 0.81 L3MBTL1 (0.54) KDM4EKMT2AMEN1POLBRAB9A
SCHEMBL4550752 0.81 L3MBTL1 (0.38) KMT2APOLBL3MBTL1MAPK1CYP1A2
Hydrochloric Acid SCHEMBL2714850 0.80 L3MBTL1 (0.37) KMT2APOLBL3MBTL1MAPK1CYP1A2
Methane SCHEMBL9827550 0.79 L3MBTL1 (0.42) KDM4EKMT2AMEN1POLBRAB9A
SCHEMBL2691394 0.78 L3MBTL1 (0.36) KMT2APOLBL3MBTL1MAPK1CYP1A2
SCHEMBL2715602 0.78 L3MBTL1 (0.38) KMT2APOLBL3MBTL1MAPK1ALDH1A1
SCHEMBL7808516 0.78 L3MBTL1 (0.48) KDM4EKMT2APOLBL3MBTL1MAPK1

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-8486962-B2 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus F2G LTD. (GB) 2013-07-16 US disclosed
EP-1888063-B1 ANTIFUNGAL AGENTS F2G LTD (GB) 2009-01-14 EP disclosed
US-20080161302-A1 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus F2G LTD. (GB) 2008-07-03 US disclosed
EP-1888063-A1 ANTIFUNGAL AGENTS F2G Ltd. (GB) 2008-02-20 EP disclosed
WO-2006123145-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2006-11-23 WO 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-20080161302-A1 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus NAT1, CYP1A2, CYP51A1 KDM4E 1505/4885KMT2A 603/4885MEN1 325/4885

“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.