SCHEMBL13023802

SCHEMBL13023802

Cc1ccc(N2c3ccccc3COc3ccoc32)c2c1CCCC2

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
GRM1 Q13255 1/20 0.31
HSD17B3 P37058 1/20 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
SCHEMBL13023785 0.86 ALDH1A1 (0.30) ALDH1A1MAPT
SCHEMBL13023798 0.84 ALDH1A1 (0.36) ALDH1A1MAPTGRM1HSD17B3
SCHEMBL13023446 0.83 HSD17B3 (0.40) ALDH1A1MAPTHSD17B3
SCHEMBL13023719 0.82 ALDH1A1 (0.33) ALDH1A1MAPTGRM1
SCHEMBL13023795 0.82 ALDH1A1 (0.38) ALDH1A1MAPTGRM1
SCHEMBL13023689 0.82 P2RX4 (0.30)
SCHEMBL13023744 0.80 MAPT (0.36) ALDH1A1MAPTGRM1HSD17B3
SCHEMBL13023797 0.79 MEN1 (0.33) GRM1
SCHEMBL13023934 0.77 NPC1 (0.33) ALDH1A1MAPT
SCHEMBL13023765 0.76 MAPT (0.40) ALDH1A1MAPT

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 ALDH1A1 579/4885MAPT 2367/4885GRM1 924/4885

“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.