SCHEMBL18758397

SCHEMBL18758397

CCOC(=O)Cc1c(F)ccc(C)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 3/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPK1 P28482 2/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 3/20 0.38
ATM Q13315 2/20 0.38
MEN1 O00255 2/20 0.38
GLA P06280 1/20 0.38
THRB P10828 1/20 0.38
CASP1 P29466 1/20 0.38
HTT P42858 1/20 0.38
CASP7 P55210 1/20 0.38
CYP1A2 P05177 1/20 0.37

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
SCHEMBL7494802 0.90 NLRP3 (0.42) NLRP3L3MBTL1GAAKDM4ELMNA
SCHEMBL6161648 0.85 MAPK1 (0.42) NLRP3L3MBTL1GAAKDM4ELMNA
SCHEMBL16964041 0.84 KMT2A (0.47) L3MBTL1KDM4ELMNAALDH1A1TSHR
SCHEMBL1867904 0.81 NLRP3 (0.54) NLRP3L3MBTL1GAAKDM4ELMNA
SCHEMBL12023029 0.80 NLRP3 (0.50) NLRP3L3MBTL1GAAKDM4ELMNA
SCHEMBL7880397 0.80 KDM4E (0.48) NLRP3L3MBTL1KDM4ELMNAALDH1A1
SCHEMBL2142648 0.79 CYP1A2 (0.45) GAAKDM4ELMNAALDH1A1MAPT
SCHEMBL3799951 0.76 GAA (0.46) L3MBTL1GAAKDM4ELMNAALDH1A1
SCHEMBL23425650 0.75 CA12 (0.50) NLRP3L3MBTL1GAAKDM4ELMNA
SCHEMBL24440124 0.75 GAA (0.43) NLRP3L3MBTL1GAAKDM4ELMNA

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-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-04-20 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-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS MAP3K6, MAP3K2, MAP3K1 NLRP3 3311/4885L3MBTL1 1150/4885GAA 2923/4885

“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.