SCHEMBL7147791

SCHEMBL7147791

CC1=C(C(=O)NNc2ccc(Cl)cc2)S(=C=O)C(c2cnccc2C(F)(F)F)=N1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
POLB P06746 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.36
PTGS2 P35354 5/20 0.35
LMNA P02545 4/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 3/20 0.35
POLQ O75417 1/20 0.35
BRAF P15056 1/20 0.34
CYP11B2 P19099 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TMPRSS4 Q9NRS4 1/20 0.33
GPBAR1 Q8TDU6 2/20 0.33
CYP17A1 P05093 1/20 0.32
TYK2 P29597 1/20 0.32
AGTR1 P30556 1/20 0.32

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
SCHEMBL6778823 0.63 NPC1 (0.58) NPC1POLBL3MBTL1ALDH1A1GAA
SCHEMBL23846539 0.60 NPC1 (0.55) NPC1POLBL3MBTL1LMNAALDH1A1
SCHEMBL28871747 0.59 PTGS2 (0.67) NPC1L3MBTL1PTGS2LMNAALDH1A1
SCHEMBL31006494 0.59 PTGS2 (0.67) NPC1L3MBTL1PTGS2LMNAALDH1A1
SCHEMBL16363154 0.57 S1PR1 (0.50) ALDH1A1BRAFGPBAR1TYK2
SCHEMBL28871731 0.57 ALDH1A1 (0.58) NPC1L3MBTL1PTGS2ALDH1A1GAA
SCHEMBL3833669 0.56 NPC1 (0.58) NPC1POLBALDH1A1TMPRSS4
SCHEMBL15236978 0.56 POLB (0.65) NPC1POLBLMNAALDH1A1
SCHEMBL9461862 0.56 PTGS2 (0.67) NPC1POLBPTGS2LMNAALDH1A1
SCHEMBL21261425 0.56 ALDH1A1 (0.71) NPC1POLBPTGS2LMNAALDH1A1

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-6521610-B2 For controlling harmful insects, acarina and nematodes HOECHST SCHERING AGREVO GMBH (DE) 2003-02-18 US claimed
US-20020013326-A1 4-Haloalkyl-3-heterocyclylpyridines and 4-haloalkyl-5-heterocyclyl-pyrimidines, processes for their preparation, compositions comprising them, and their use as pesticides TIEBES JORG (DE) 2002-01-31 US claimed

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-20020013326-A1 4-Haloalkyl-3-heterocyclylpyridines and 4-haloalkyl-5-heterocyclyl-pyrimidines, processes for their preparation, compositions comprising them, and their use as pesticides DDT, HAX1, HDHD5 NPC1 3514/4885POLB 2336/4885L3MBTL1 1476/4885

“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.