SCHEMBL4900975

SCHEMBL4900975

O=C(NN=Cc1cc(Br)c(O)c(Br)c1)c1cc(OC(F)(F)F)ccc1OC(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
MAPT P10636 2/20 0.52
LMNA P02545 1/20 0.52
GCGR P47871 2/20 0.48
POLB P06746 2/20 0.47
ASF1A Q9Y294 4/20 0.46
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45
ATM Q13315 1/20 0.45
MCL1 Q07820 1/20 0.44
CHEK1 O14757 1/20 0.44
AURKA O14965 1/20 0.44
DAPK3 O43293 1/20 0.44
JAK2 O60674 1/20 0.44
PRKD3 O94806 1/20 0.44
MAP4K4 O95819 1/20 0.44
PAK4 O96013 1/20 0.44
ABL1 P00519 1/20 0.44

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
SCHEMBL1669478 0.84 MEN1 (0.61) MEN1KMT2AMAPTLMNAGCGR
SCHEMBL3632266 0.84 MEN1 (0.61) MEN1KMT2AMAPTLMNAGCGR
SCHEMBL3667153 0.82 MEN1 (0.71) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL3667154 0.82 MEN1 (0.71) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL1669532 0.78 MAPT (0.66) MEN1KMT2AMAPTLMNAGCGR
SCHEMBL1669533 0.78 MAPT (0.66) MEN1KMT2AMAPTLMNAGCGR
SCHEMBL1669307 0.77 KMT2A (0.64) MEN1KMT2AMAPTLMNAGCGR
SCHEMBL1669312 0.77 KMT2A (0.64) MEN1KMT2AMAPTLMNAGCGR
SCHEMBL3630336 0.77 KMT2A (0.55) MEN1KMT2AMAPTLMNAGCGR
SCHEMBL3630338 0.77 KMT2A (0.55) MEN1KMT2AMAPTLMNAGCGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283351-B2 Inhibiting cyctic fibrosis transmembrane conductance regulator polypeptide ; therapy for diarrhea and polycystic kidney disease INSTITUTE FOR ONEWORLD HEALTH (US) 2012-10-09 US disclosed
US-20080269206-A1 CFTR INHIBITOR COMPOUNDS AND USES THEREOF INSTITUTE FOR ONEWORLD HEALTH 2008-10-30 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-20080269206-A1 CFTR INHIBITOR COMPOUNDS AND USES THEREOF CFTR, PKD1, PKD2 MEN1 2759/4885KMT2A 4688/4885MAPT 4853/4885

“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.