SCHEMBL13022504

SCHEMBL13022504

Cc1ccc2c(c1)[S+]([O-])c1ccccc1N2c1ccccc1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.40
NR1H2 P55055 1/20 0.35
ALDH1A1 P00352 4/20 0.35
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PSMB5 P28074 1/20 0.33
HDAC7 Q8WUI4 1/20 0.32
HPRT1 P00492 1/20 0.32
HTR1A P08908 1/20 0.32
HTR2A P28223 1/20 0.32
HTR7 P34969 1/20 0.32
HTR5A P47898 1/20 0.32
HTR6 P50406 1/20 0.32
LMNA P02545 2/20 0.31
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
MAOB P27338 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31

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
SCHEMBL13021696 0.97 MGLL (0.41) MGLLNR1H2ALDH1A1HTTHSD17B10
SCHEMBL13023284 0.92 HDAC7 (0.36) MGLLNR1H2ALDH1A1PSMB5HDAC7
SCHEMBL13021981 0.84 MGLL (0.34) MGLLNR1H2ALDH1A1MAOB
SCHEMBL13022501 0.82 MGLL (0.39) MGLLALDH1A1HTTLMNAMAPT
SCHEMBL13021678 0.79 MGLL (0.41) MGLLALDH1A1HTTHSD17B10LMNA
SCHEMBL13023263 0.79 NPSR1 (0.38) MGLLALDH1A1HTTLMNANPSR1
SCHEMBL13023693 0.79 HDAC7 (0.30) HDAC7
SCHEMBL13022506 0.78 MGLL (0.42) MGLLALDH1A1HTTHTR1AHTR2A
SCHEMBL13022708 0.77 MGLL (0.37) MGLLNR1H2ALDH1A1HTTHSD17B10
SCHEMBL13022532 0.77 KMT2A (0.33) ALDH1A1HTTHTR1ANPSR1MAPT

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-20100286360-A1 POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-11 US disclosed
US-20100286360-A1 POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-11 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-20100286360-A1 POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME IGF1R, SCO2, CRY1 MGLL 1758/4885NR1H2 1953/4885ALDH1A1 579/4885

“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.