SCHEMBL15504635

SCHEMBL15504635

CC(=O)N(C)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
POLB P06746 1/20 0.53
ALDH1A1 P00352 3/20 0.48
HTT P42858 1/20 0.48
EPHX2 P34913 1/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
RXRA P19793 2/20 0.46
NR1H2 P55055 2/20 0.46
NR1H3 Q13133 2/20 0.46
SRD5A1 P18405 4/20 0.46
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45

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
SCHEMBL1875890 0.86 SERPINE1 (0.49) MAPTPOLBEPHX2HDAC3HDAC4
SCHEMBL13871456 0.84 EPHX2 (0.46) MAPTPOLBALDH1A1EPHX2HDAC3
SCHEMBL5535914 0.84 GPBAR1 (0.46) MAPTPOLBALDH1A1EPHX2HDAC3
SCHEMBL28865681 0.83 EPHX2 (0.42) MAPTSMN1; SMN2POLBALDH1A1EPHX2
SCHEMBL23084362 0.82 MAPT (0.47) MAPTALDH1A1HTTEPHX2LMNA
SCHEMBL21649311 0.81 POLB (0.48) POLBEPHX2LMNAHDAC3HDAC4
SCHEMBL14518800 0.81 MLYCD (0.59) ALDH1A1HTTEPHX2LMNAHDAC3
SCHEMBL28980342 0.81 EPHX2 (0.46) POLBEPHX2HDAC3HDAC4HDAC1
SCHEMBL22312030 0.80 POLB (0.43) POLBEPHX2LMNAHDAC3HDAC4
SCHEMBL7665673 0.80 PAX8 (0.45) HTTEPHX2LMNARXRANR1H2

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-11160280-B2 Pesticial compounds BASF SE (DE) 2021-11-02 US disclosed
US-20200029566-A1 Pesticial Compounds BASF SE (DE) 2020-01-30 US disclosed
WO-2014039714-A2 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. (US) 2014-03-13 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 (2 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-11160280-B2 Pesticial compounds PNMT, DDT, NIT2 MAPT 108/4885SMN1; SMN2 679/4885POLB 2894/4885
US-20200029566-A1 Pesticial Compounds PNMT, DDT, NIT2 MAPT 108/4885SMN1; SMN2 679/4885POLB 2894/4885

“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.