SCHEMBL5752604

SCHEMBL5752604

CC(C)Nc1nc(NN)nc(Cl)c1-c1c(F)cc(F)cc1F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPK14 Q16539 1/20 0.32
GAA P10253 1/20 0.30
GLP1R P43220 1/20 0.30
KCNH3 Q9ULD8 1/20 0.30

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
SCHEMBL4835877 0.87 IDH1 (0.33) TDP1MEN1ALDH1A1MAPTPKM
SCHEMBL5751003 0.78
SCHEMBL14000740 0.78 GLP1R (0.33) MAPK14GLP1R
SCHEMBL4826868 0.76 GLP1R (0.42) ALDH1A1RAB9AGLP1R
SCHEMBL4021311 0.72 TRPM8 (0.47) TDP1MEN1MAPTRAB9AKMT2A
SCHEMBL14000746 0.69 IDH1 (0.34) KCNH3
SCHEMBL3568691 0.69 IDH1 (0.39) MEN1ALDH1A1KMT2A
SCHEMBL13114687 0.69 IDH1 (0.39) MEN1ALDH1A1KMT2A
SCHEMBL4835820 0.69 LMNA (0.30) GAA
SCHEMBL14000744 0.69 LMNA (0.30) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060199801-A1 Heterobicyclic compounds used as fungicides BASF AKTIENGESELLSCHAFT (DE) 2006-09-07 US disclosed
EP-1620436-A1 HETEROBICYCLIC COMPOUNDS USED AS FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2006-02-01 EP disclosed
WO-2004092175-A1 HETEROBICYCLIC COMPOUNDS USED AS FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2004-10-28 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-20060199801-A1 Heterobicyclic compounds used as fungicides CBR3, CBR1, CYP2A6 BCL6 597/4885TDP1 3389/4885MEN1 1826/4885

“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.