SCHEMBL17628547

SCHEMBL17628547

CCN(C(=O)O)c1ccc(Oc2ccc(OC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RNF4 P78317 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.51
TSHR P16473 2/20 0.47
ALDH1A1 P00352 3/20 0.46
PARP10 Q53GL7 1/20 0.46
LTA4H P09960 2/20 0.46
BCL2A1 Q16548 2/20 0.45
TRPM8 Q7Z2W7 2/20 0.45
NR3C1 P04150 1/20 0.45
PGR P06401 1/20 0.45
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GLA P06280 1/20 0.44
PDK2 Q15119 1/20 0.44
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43

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
SCHEMBL5702218 0.95 RNF4 (0.51) RNF4SMN1; SMN2TSHRALDH1A1BCL2A1
SCHEMBL249712 0.90 RNF4 (0.48) RNF4SMN1; SMN2TSHRALDH1A1BCL2A1
SCHEMBL15984777 0.81 SMN1; SMN2 (0.62) RNF4SMN1; SMN2TSHRALDH1A1BCL2A1
SCHEMBL11875667 0.79 SMN1; SMN2 (0.47) RNF4SMN1; SMN2TSHRALDH1A1BCL2A1
SCHEMBL14577947 0.79 TSHR (0.49) RNF4SMN1; SMN2TSHRALDH1A1PARP10
SCHEMBL5454456 0.79 HTT (0.51) RNF4SMN1; SMN2TSHRALDH1A1BCL2A1
SCHEMBL7044788 0.78 TSHR (0.51) RNF4TSHRALDH1A1BCL2A1TRPM8
SCHEMBL6801988 0.78 TSHR (0.58) SMN1; SMN2TSHRALDH1A1MAPTL3MBTL1
SCHEMBL545097 0.78 TSHR (0.45) RNF4SMN1; SMN2TSHRALDH1A1BCL2A1
SCHEMBL15054523 0.78 RNF4 (0.49) RNF4TSHRALDH1A1BCL2A1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9517651-B2 Developer for thermal recording media and thermal composition media using the same PERFORMANCE CHEMICALS, INC. (US) 2016-12-13 US disclosed
US-20160089919-A1 NOVEL DEVELOPER FOR THERMAL RECORDING MEDIA AND THERMAL COMPOSITION MEDIA USING THE SAME MARUBENI AMERICA CORPORATION 2016-03-31 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-20160089919-A1 NOVEL DEVELOPER FOR THERMAL RECORDING MEDIA AND THERMAL COMPOSITION MEDIA USING THE SAME HPD, PNMT, HTR3C RNF4 870/4885SMN1; SMN2 3135/4885TSHR 3887/4885

“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.