SCHEMBL20062905

SCHEMBL20062905

Cc1cc2c(cc1C)N(c1ccncc1)C(=C1N(c3ccncc3)c3cc(C)c(C)cc3N1c1ccncc1)N2c1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.42
AR P10275 1/20 0.38
CHKA P35790 1/20 0.34
ALDH1A1 P00352 3/20 0.34
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FLT3 P36888 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
GSK3B P49841 1/20 0.33
USP2 O75604 1/20 0.33
MAPK14 Q16539 1/20 0.33
ALOX5 P09917 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ADRB2 P07550 1/20 0.31
NCF1 P14598 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
SCHEMBL18905736 0.78 ELANE (0.48) ALDH1A1KDM4EHPGDSMN1; SMN2LMNA
SCHEMBL17383518 0.78 NPC1 (0.45) BCHEALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL20062884 0.77 CYP2A6 (0.50) ARALDH1A1L3MBTL1
SCHEMBL20062903 0.76 BCHE (0.46) BCHEARCHKAALDH1A1KDM4E
SCHEMBL18905756 0.75 NPC1 (0.42) BCHEALDH1A1KDM4EHPGDLMNA
SCHEMBL18905653 0.75 MEN1 (0.42) POLBL3MBTL1KDM4ESMN1; SMN2LMNA
SCHEMBL20062906 0.74 KIF11 (0.43) BCHEARALDH1A1POLBHPGD
SCHEMBL18905740 0.74 KMT2A (0.50) ALDH1A1KDM4EHPGDSMN1; SMN2LMNA
SCHEMBL20071970 0.73 ADRB2 (0.34) BCHEARCHKAALDH1A1POLB
SCHEMBL18964694 0.73 CHKA (0.38) BCHECHKAALDH1A1POLBL3MBTL1

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-20180108691-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL AREA SENSOR, IMAGING DEVICE, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2018-04-19 US disclosed