SCHEMBL4236498

SCHEMBL4236498

CN1C(=O)C(Cc2ccccc2)N(C)C(=O)/C1=C/c1ccccc1-c1nccs1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.39
TRPA1 O75762 1/20 0.37
PORCN Q9H237 1/20 0.34
INSR P06213 1/20 0.34
ALK Q9UM73 1/20 0.34
PDPK1 O15530 1/20 0.33
CAPN1 P07384 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
KDR P35968 1/20 0.32
ESR1 P03372 1/20 0.32
CES2 O00748 1/20 0.32
PLK1 P53350 1/20 0.32
PLK3 Q9H4B4 1/20 0.32
PLK2 Q9NYY3 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31

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
SCHEMBL3119585 1.00 GFER (0.39) GFERTRPA1PORCNINSRALK
SCHEMBL3113702 0.79 GFER (0.41) GFERCAPN1CES2ALDH1A1TACR1
SCHEMBL4234097 0.79 GFER (0.41) GFERCAPN1CES2ALDH1A1TACR1
SCHEMBL3113775 0.79 GFER (0.37) GFERCAPN1CES2ALDH1A1TACR1
SCHEMBL3113774 0.79 GFER (0.37) GFERCAPN1CES2ALDH1A1TACR1
SCHEMBL2793360 0.77 GFER (0.41) GFERCAPN1CES2TACR1MEN1
SCHEMBL2793358 0.77 GFER (0.41) GFERCAPN1CES2TACR1MEN1
SCHEMBL3121578 0.76 MMP2 (0.36) GFERCAPN1CES2ALDH1A1TACR1
SCHEMBL3112948 0.76 GFER (0.35) GFERCAPN1CES2ALDH1A1TACR1
SCHEMBL3121585 0.76 MMP2 (0.36) GFERCAPN1CES2ALDH1A1TACR1

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-20090137396-A1 Piperazine Compounds with a Herbicidal Action BASF SE (DE) 2009-05-28 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-20090137396-A1 Piperazine Compounds with a Herbicidal Action DDT, CIP2A, PFAS GFER 1334/4885TRPA1 757/4885PORCN 3584/4885

“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.