SCHEMBL5928016

SCHEMBL5928016

Cc1cc(Cl)nc(SCCC(F)=C(F)F)n1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 3/20 0.40
POLB P06746 2/20 0.40
HTT P42858 2/20 0.39
RXRA P19793 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL22179679 0.83 HSD17B10 (0.48) HSD17B10L3MBTL1KDM4EMEN1KMT2A
SCHEMBL11272018 0.73 LMNA (0.52) L3MBTL1KDM4EMEN1KMT2AGAA
SCHEMBL22179856 0.69 POLB (0.54) HSD17B10L3MBTL1KDM4EMEN1KMT2A
SCHEMBL11833478 0.68 LMNA (0.46) L3MBTL1KDM4EMEN1KMT2AGAA
SCHEMBL1902046 0.67 POLB (0.47) KDM4EMEN1KMT2AGAALMNA
SCHEMBL8751989 0.66 KDM4E (0.50) HSD17B10KDM4EMEN1KMT2ALMNA
SCHEMBL6802526 0.66 KDM4E (0.40) KDM4ELMNAALDH1A1POLB
SCHEMBL6803468 0.66 KDM4E (0.40) KDM4ELMNAALDH1A1POLB
SCHEMBL4681763 0.65 LMNA (0.61) HSD17B10L3MBTL1KDM4EMEN1KMT2A
SCHEMBL17209317 0.65 KMT2A (0.55) KDM4EKMT2AGAALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060106042-A1 Substituted heterocyclpyrmidines BAYER CROPSCIENCE AG (DE) 2006-05-18 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-20060106042-A1 Substituted heterocyclpyrmidines DDT, ZYX, PFAS HSD17B10 3050/4885L3MBTL1 2234/4885KDM4E 1505/4885

“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.