SCHEMBL13325636

SCHEMBL13325636

c1ccc(-c2ccc(-c3ncc4c5ccccc5cnn34)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 4/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
PLK1 P53350 2/20 0.36
MAPT P10636 3/20 0.36
CHEK1 O14757 1/20 0.36
LIMK1 P53667 1/20 0.36
MAPK14 Q16539 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA1 P30542 1/20 0.35
MEN1 O00255 1/20 0.35
HSP90AA1 P07900 1/20 0.35
NR3C1 P04150 1/20 0.35

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
SCHEMBL6350431 0.73 RXFP1 (0.44) TLR7ALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL10711454 0.71 NPC1 (0.55) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL28546185 0.67 SMN1; SMN2 (0.42) TLR7ALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL18104285 0.62 AKT1 (0.48) SMN1; SMN2KDM4ENPC1RAB9AMAPT
SCHEMBL21250771 0.60 KDM4E (0.60) SMN1; SMN2KDM4ENPC1RAB9AMAPT
SCHEMBL7068732 0.60 ERCC1 (0.54) NR3C1
SCHEMBL12074301 0.60 PRKCZ (0.73)
SCHEMBL9382619 0.60 IDO1 (0.46) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL12145842 0.59 NPC1 (0.45) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A
Tannin Pyrogallol SCHEMBL9715545 0.59 ALDH1A1 (0.69) ALDH1A1RAB9ATDP1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 US disclosed
US-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed