SCHEMBL10245034

SCHEMBL10245034

CCCc1cccc(-c2ccco2)c1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.64
PSMB5 P28074 3/20 0.52
TAAR1 Q96RJ0 2/20 0.47
KEAP1 Q14145 1/20 0.46
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
POLB P06746 1/20 0.41
RECQL P46063 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
EGFR P00533 1/20 0.40
CLK4 Q9HAZ1 1/20 0.38
CETP P11597 1/20 0.37

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
SCHEMBL14048817 0.90 PRMT6 (0.60) PRMT6PSMB5TAAR1KEAP1KDM4E
SCHEMBL14141440 0.86 PRMT6 (0.68) PRMT6PSMB5TAAR1KEAP1KDM4E
SCHEMBL1347949 0.83 PRMT6 (0.59) PRMT6PSMB5TAAR1KEAP1KDM4E
SCHEMBL1346211 0.83 PRMT6 (0.59) PRMT6PSMB5TAAR1KEAP1KDM4E
SCHEMBL12133815 0.82 PRMT6 (0.59) PRMT6PSMB5TAAR1KEAP1
SCHEMBL10190883 0.81 PRMT6 (0.62) PRMT6PSMB5TAAR1KEAP1KDM4E
SCHEMBL10243010 0.81 PRMT6 (0.54) PRMT6PSMB5TAAR1KEAP1KDM4E
SCHEMBL10242910 0.80 PRMT6 (0.53) PRMT6PSMB5TAAR1KEAP1CTSS
SCHEMBL30777855 0.79 CTSS (0.51) PRMT6CTSSCTSK
SCHEMBL196298 0.79 CTSS (0.51) PRMT6CTSSCTSK

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-20120022043-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2012-01-26 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-20120022043-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 PRMT6 710/4885PSMB5 2112/4885TAAR1 2641/4885

“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.