SCHEMBL15932124

SCHEMBL15932124

CC(=O)CCCc1ccc2c(c1)OC(F)(F)O2

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 3/20 0.46
WNT3A P56704 3/20 0.46
FAAH O00519 4/20 0.40
PTGDR Q13258 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
CYP2D6 P10635 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
ROCK2 O75116 1/20 0.37
SMYD3 Q9H7B4 1/20 0.37
HSD17B10 Q99714 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA2B P29275 1/20 0.36
ADORA1 P30542 1/20 0.36

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
SCHEMBL934525 0.87 CTNNB1 (0.47) CTNNB1WNT3AFAAHMRGPRX4CYP2D6
SCHEMBL28664343 0.82 CYP4Z1 (0.45) CTNNB1WNT3AFAAHMRGPRX4CYP2D6
SCHEMBL29127892 0.80 CTNNB1 (0.52) CTNNB1WNT3AFAAHMRGPRX4
SCHEMBL80862 0.80 CTNNB1 (0.41) CTNNB1WNT3AFAAHPTGDRMRGPRX4
SCHEMBL80920 0.78 FAAH (0.40) CTNNB1WNT3AFAAHPTGDRMRGPRX4
SCHEMBL25020569 0.77 ALOX15 (0.48) HDAC3HDAC1HDAC2HDAC6
SCHEMBL17298749 0.77 ALDH1A1 (0.39) CTNNB1WNT3AFAAHPTGDRMRGPRX4
SCHEMBL22657669 0.76 CTNNB1 (0.43) CTNNB1WNT3AFAAHPTGDRMRGPRX4
SCHEMBL8367478 0.76 CNR1 (0.40) CTNNB1WNT3AFAAHPTGDRMRGPRX4
SCHEMBL15931848 0.76 HDAC1 (0.62) HDAC3HDAC1HDAC2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9814235-B2 Method for controlling arthropod pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-14 US disclosed
US-9814235-B2 Method for controlling arthropod pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-14 US disclosed
US-20150344466-A1 METHOD FOR CONTROLLING ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-12-03 US disclosed
US-20150344466-A1 METHOD FOR CONTROLLING ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-12-03 US disclosed
WO-2014119696-A1 METHOD FOR CONTROLLING ARTHROPOD PEST 住友化学株式会社 (JP) 2014-08-07 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 (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-20150344466-A1 METHOD FOR CONTROLLING ARTHROPOD PEST H1-0, H1-3, H1-2 CTNNB1 2851/4885WNT3A 1554/4885FAAH 218/4885

“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.