SCHEMBL17356808

SCHEMBL17356808

CC1CCC1c1c(C(F)(F)F)cccc1C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.53
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
HTR2C P28335 8/20 0.37
HTR2B P41595 5/20 0.37
GRM2 Q14416 1/20 0.36
NOTUM Q6P988 1/20 0.34
GAA P10253 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTR2A P28223 5/20 0.33
HRH1 P35367 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL17356809 0.89 PNMT (0.46) PNMTCHRNB2CHRNA4TAS1R3TAS1R1
SCHEMBL17356789 0.80 TAS1R3 (0.44) PNMTCHRNB2CHRNA4TAS1R3TAS1R1
SCHEMBL17356806 0.79 HTR2C (0.50) PNMTCHRNB2CHRNA4HTR2CHTR2B
SCHEMBL17356805 0.70 PNMT (0.43) PNMTCHRNB2CHRNA4TAS1R3TAS1R1
SCHEMBL14135945 0.70 PNMT (0.42) PNMTCHRNB2CHRNA4TAS1R3TAS1R1
SCHEMBL13632697 0.69 PNMT (0.49) PNMTCHRNB2CHRNA4HTR2CGRM2
SCHEMBL17356804 0.69 HTR2C (0.47) PNMTTAS1R3TAS1R1TAS1R2HTR2C
SCHEMBL21067929 0.69 PNMT (1.00) PNMTCHRNB2CHRNA4HTR2CHTR2B
SCHEMBL17356798 0.69 GAA (0.51) PNMTTAS1R3TAS1R1TAS1R2HTR2C
SCHEMBL25044023 0.67 PNMT (0.43) PNMTCHRNB2CHRNA4TAS1R3TAS1R1

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-20170313792-A1 METHOD FOR PRODUCING POLAR GROUP-CONTAINING OLEFIN POLYMER THE UNIVERSITY OF TOKYO (JP) 2017-11-02 US disclosed
US-9499644-B2 Production method of polar group-containing olefin polymers SHOWA DENKO K.K. (JP) 2016-11-22 US disclosed
US-20150368376-A1 PRODUCTION METHOD OF POLAR GROUP-CONTAINING OLEFIN POLYMERS SHOWA DENKO K.K. (JP) 2015-12-24 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-20150368376-A1 PRODUCTION METHOD OF POLAR GROUP-CONTAINING OLEFIN POLYMERS OR10J3, OPRM1, ORC3 PNMT 316/4885CHRNB2 1890/4885CHRNA4 923/4885

“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.