SCHEMBL2618015

SCHEMBL2618015

CC(=O)Nc1cc(S(=O)(=O)O)cc2cc(C)cc(O)c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.55
CASP6 P55212 1/20 0.46
NT5E P21589 2/20 0.44
CASR P41180 1/20 0.43
PRMT1 Q99873 2/20 0.39
CA2 P00918 6/20 0.38
CA1 P00915 5/20 0.38
CA9 Q16790 5/20 0.38
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CA12 O43570 1/20 0.36
CA3 P07451 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PTPN1 P18031 1/20 0.35
SNCA P37840 1/20 0.35

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
SCHEMBL1413179 0.91 APEX1 (0.64) APEX1CASP6NT5ECASRPRMT1
SCHEMBL29516436 0.91 APEX1 (0.64) APEX1CASP6NT5ECASRPRMT1
SCHEMBL29575995 0.91 APEX1 (0.64) APEX1CASP6NT5ECASRPRMT1
SCHEMBL5147103 0.90 APEX1 (0.63) APEX1CASP6NT5ECASRPRMT1
SCHEMBL8010537 0.90 APEX1 (0.63) APEX1CASP6NT5ECASRPRMT1
Phenol SCHEMBL11600632 0.83 APEX1 (0.69) APEX1CASP6NT5ECASRPRMT1
SCHEMBL11773973 0.81 CASP6 (0.59) APEX1CASP6NT5ECASRPRMT1
SCHEMBL13534219 0.80 NT5E (0.61) APEX1CASP6NT5EPRMT1PTPN1
SCHEMBL1807848 0.80 CASP6 (0.50) APEX1CASP6NT5ECASRPRMT1
SCHEMBL10901189 0.79 APEX1 (0.68) APEX1CASP6NT5ECASRPRMT1

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-8664371-B2 Rinsable dyes and methods for their preparation Spectra Colors Corp. (US) 2014-03-04 US disclosed
US-20120101264-A1 Rinsable dyes and methods for their preparation Spectra Colors Corp. 2012-04-26 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-20120101264-A1 Rinsable dyes and methods for their preparation ARSA, HNRNPUL1, ALKBH1 APEX1 1266/4885CASP6 929/4885NT5E 2151/4885

“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.