SCHEMBL13309028

SCHEMBL13309028

CN1c2cc3ccccc3cc2-c2cccc3cccc1c23

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.53
▸ HPGD P15428 7/20 0.53
▸ HSD17B10 Q99714 5/20 0.53
▸ CASP1 P29466 4/20 0.53
▸ MAPK1 P28482 4/20 0.53
▸ TSHR P16473 3/20 0.53
▸ CASP7 P55210 2/20 0.53
▸ HIF1A Q16665 2/20 0.53
▸ TP53 P04637 1/20 0.53
▸ KDM4E B2RXH2 4/20 0.53
▸ GAA P10253 4/20 0.53
▸ MAPT P10636 4/20 0.53
▸ HTT P42858 1/20 0.53
▸ KMT2A Q03164 5/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ NSD2 O96028 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MPI P34949 1/20 0.40

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
SCHEMBL12258292 0.85 ALDH1A1 (0.59) ALDH1A1HPGDHSD17B10CASP1MAPK1
SCHEMBL12775944 0.85 ALDH1A1 (0.43) ALDH1A1HPGDHSD17B10CASP1MAPK1
SCHEMBL12793268 0.83 AKT1 (0.45) ALDH1A1HPGDHSD17B10CASP1MAPK1
SCHEMBL12793285 0.80 AKT1 (0.43) ALDH1A1HPGDHSD17B10CASP1MAPK1
SCHEMBL14156350 0.74 MAOA (0.46) ALDH1A1HPGDHSD17B10KDM4EGAA
SCHEMBL2330603 0.73 MAOA (0.44) ALDH1A1KDM4EKMT2AMEN1L3MBTL1
SCHEMBL12258293 0.72 KMT2A (0.61) ALDH1A1HPGDHSD17B10CASP1TSHR
SCHEMBL1101925 0.72 KMT2A (0.62) ALDH1A1HPGDHSD17B10CASP1CASP7
SCHEMBL8363927 0.72 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10CASP1MAPK1
SCHEMBL13309025 0.71 ALDH1A1 (0.49) ALDH1A1HPGDHSD17B10CASP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100157202-A1 CONJUGATED POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 — — 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-20100157202-A1 CONJUGATED POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SLC30A6, SLC43A1, SLC39A3 ALDH1A1 2399/4885HPGD 4412/4885HSD17B10 3607/4885

“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.

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