SCHEMBL13022708

SCHEMBL13022708

Cc1cc2c(o1)N(c1ccccc1-c1ccccc1)c1ccccc1[S+]2[O-]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.37
NR1H2 P55055 1/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP1A1 P04798 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP1B1 Q16678 2/20 0.32
HTT P42858 3/20 0.32
HSD17B10 Q99714 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTR1A P08908 1/20 0.30

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
SCHEMBL13021981 0.90 MGLL (0.34) MGLLNR1H2ALDH1A1CYP1A1CYP1A2
SCHEMBL13022696 0.84 MGLL (0.36) MGLLMEN1KMT2ASMN1; SMN2
SCHEMBL13022699 0.80 MGLL (0.39) MGLLALDH1A1HTTHSD17B10KDM4E
SCHEMBL13022721 0.78
SCHEMBL13022504 0.77 MGLL (0.40) MGLLNR1H2ALDH1A1HTTHSD17B10
SCHEMBL13022724 0.76
SCHEMBL13022798 0.76 KDM4E (0.40) ALDH1A1CYP1A1CYP1A2CYP1B1HTT
SCHEMBL13022710 0.75 ALDH1A1 (0.32) ALDH1A1HTTKDM4EMEN1KMT2A
SCHEMBL13021956 0.74 MGLL (0.33) MGLLALDH1A1MEN1KMT2A
SCHEMBL13021696 0.74 MGLL (0.41) MGLLNR1H2ALDH1A1HTTHSD17B10

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.