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Sugi Predict / Compounds / SCHEMBL13699652

SCHEMBL13699652

SCHEMBL13699652

C=Cc1ccc2c(c1)c1cncnc1n2-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 12/20 0.37
▸ CYP3A4 P08684 9/20 0.37
▸ CYP2C9 P11712 8/20 0.37
▸ HSD17B10 Q99714 6/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ USP2 O75604 10/20 0.36
▸ CYP2C19 P33261 9/20 0.36
▸ MAPK1 P28482 4/20 0.36
▸ TSHR P16473 6/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ CASP1 P29466 3/20 0.34
▸ CASP7 P55210 3/20 0.34
▸ HBB P68871 1/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ CLK4 Q9HAZ1 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL13699653 0.82 KDM4E (0.36) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL21732510 0.80 KDM4E (0.50) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL26478049 0.80 CYP1A2 (0.44) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL12396569 0.79 KDM4E (0.55) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL9968053 0.77 CYP1A2 (0.40) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL23438572 0.77 CYP1A2 (0.50) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL11823335 0.76 KDM4E (0.60) HSD17B10ALDH1A1USP2MAPK1TSHR
SCHEMBL26329800 0.76 KDM4E (0.45) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL26329875 0.76 KDM4E (0.41) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1
SCHEMBL26329758 0.75 KDM4E (0.41) CYP1A2CYP3A4CYP2C9HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9130183-B2 Organic electroluminescent element, displaying device and lighting device Konica Minolta, Inc. (JP) 2015-09-08 — — US disclosed
US-9130183-B2 Organic electroluminescent element, displaying device and lighting device Konica Minolta, Inc. (JP) 2015-09-08 — — US disclosed
US-8758903-B2 Organic electroluminescent element, display device and lighting device KONICA MINOLTA HOLDINGS, INC. (JP) 2014-06-24 — — US disclosed
US-8758903-B2 Organic electroluminescent element, display device and lighting device KONICA MINOLTA HOLDINGS, INC. (JP) 2014-06-24 — — US disclosed
EP-1953843-B1 ORGANIC ELECTROLUMINESCENT DEVICE, DISPLAY AND ILLUMINATING DEVICE KONICA MINOLTA HOLDINGS INC (JP) 2012-12-05 — — EP disclosed
US-20090239000-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND LIGHTING DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2009-09-24 — — US disclosed
US-20090239000-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE AND LIGHTING DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2009-09-24 — — US disclosed
US-20090033213-A1 Organic Electroluminescent Element, Displaying Device and Lighting Device KONICA MINOLTA HOLDINGS, INC. (JP) 2009-02-05 — — US disclosed
US-20090033213-A1 Organic Electroluminescent Element, Displaying Device and Lighting Device KONICA MINOLTA HOLDINGS, INC. (JP) 2009-02-05 — — US disclosed
EP-1953843-A1 ORGANIC ELECTROLUMINESCENT DEVICE, DISPLAY AND ILLUMINATING DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2008-08-06 — — EP disclosed