SCHEMBL1610694

SCHEMBL1610694

CCC[CH]c1c2ccccc2cc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
HTR2A P28223 1/20 0.41
AMY1A P0DUB6 1/20 0.40
POLB P06746 2/20 0.38
GAA P10253 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RAD52 P43351 1/20 0.37
ALDH1A1 P00352 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
HSD17B10 Q99714 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HIF1A Q16665 1/20 0.37
CYP1B1 Q16678 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
CYP1A2 P05177 2/20 0.36

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
SCHEMBL1610558 0.89 GAA (0.43) NR1I2L3MBTL1HTR2AAMY1APOLB
SCHEMBL1611367 0.87 GAA (0.42) NR1I2L3MBTL1HTR2AAMY1AGAA
SCHEMBL1610935 0.85 MAPT (0.44) NR1I2L3MBTL1HTR2AGAATDP1
SCHEMBL1610099 0.85 MAPT (0.44) NR1I2L3MBTL1HTR2AGAATDP1
SCHEMBL1613222 0.85 NR1I2 (0.47) NR1I2L3MBTL1HTR2AAMY1APOLB
SCHEMBL7708750 0.80 HTR2A (0.41) NR1I2L3MBTL1HTR2AAMY1APOLB
SCHEMBL5609949 0.79 TSHR (0.47) L3MBTL1POLBGAATDP1LMNA
SCHEMBL7702826 0.77 HTR2A (0.38) NR1I2L3MBTL1HTR2AAMY1APOLB
SCHEMBL303010 0.76 ALDH1A1 (0.41) L3MBTL1HTR2AGAAMEN1KMT2A
SCHEMBL5012412 0.75 L3MBTL1 (0.39) L3MBTL1POLBGAATDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105324373-A Tetrazolinone compound and use thereof SUMITOMO CHEMICAL CO 2016-02-10 CN disclosed
US-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 NR1I2 651/4885L3MBTL1 236/4885HTR2A 599/4885

“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.