SCHEMBL1013113

SCHEMBL1013113

O=C(Cl)c1ccc(OC(F)F)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.50
MEN1 O00255 11/20 0.50
KMT2A Q03164 11/20 0.50
HTT P42858 7/20 0.50
NPSR1 Q6W5P4 2/20 0.50
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 7/20 0.49
ALDH1A1 P00352 5/20 0.49
TP53 P04637 1/20 0.49
HTR1E P28566 1/20 0.49
S1PR3 Q99500 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
NPC1 O15118 3/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
GAA P10253 1/20 0.46

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
SCHEMBL1014876 0.86 TSHR (0.53) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL6814857 0.86 PDE4D (0.54) HTTTP53RAB9ASMN1; SMN2NPC1
SCHEMBL2282127 0.85 MAPT (0.52) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL1014238 0.83 RORC (0.56) MEN1KMT2ALMNAS1PR3SMN1; SMN2
SCHEMBL25212586 0.82 MAPT (0.52) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL24959708 0.81 MAPT (0.55) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL16960272 0.81 MAPT (0.48) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL4696721 0.80 KDM4E (0.58) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL4310784 0.77 MAPT (0.52) MAPTMEN1KMT2AHTTNPSR1
SCHEMBL4309471 0.77 HSD17B1 (0.44) MAPTMEN1KMT2AHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250026762-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-01-23 US disclosed
EP-4441034-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Merck Sharp & Dohme LLC (US) 2024-10-09 EP disclosed
WO-2023101895-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-06-08 WO disclosed
US-8329730-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-12-11 US disclosed
US-8329730-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-12-11 US disclosed
US-8329730-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-12-11 US disclosed
EP-2271643-B1 OXADIAZOLES AS S1P1 RECEPTOR AGONISTS GLAXO GROUP LTD (GB) 2012-08-15 EP disclosed
EP-2271643-B1 OXADIAZOLES AS S1P1 RECEPTOR AGONISTS GLAXO GROUP LTD (GB) 2012-08-15 EP disclosed
US-20110039889-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-02-17 US disclosed
US-20110039889-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-02-17 US disclosed
US-20110039889-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-02-17 US disclosed
EP-2271643-A1 COMPOUNDS Glaxo Group Limited (GB) 2011-01-12 EP disclosed
WO-2009133136-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-11-05 WO disclosed
WO-2009133136-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-11-05 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 (2 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-20110039889-A1 COMPOUNDS CYP11B2, CYP11B1, GLS2 MAPT 1092/4885MEN1 2901/4885KMT2A 4598/4885
US-20250026762-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, UGCG MAPT 1472/4885MEN1 2365/4885KMT2A 4336/4885

“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.