SCHEMBL27636147

SCHEMBL27636147

c1ccc2c(c1)ccc1cc(-c3nccs3)ccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.53
RAB9A P51151 2/20 0.47
CYP2A6 P11509 2/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
MAPT P10636 3/20 0.43
RIOK2 Q9BVS4 2/20 0.43
MAPK1 P28482 2/20 0.43
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
HSP90AA1 P07900 1/20 0.43
PAX8 Q06710 1/20 0.43
KCNH2 Q12809 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL10013454 0.92 PDPK1 (0.52) PDPK1RAB9ACYP2A6LOXL2HSP90AA1
SCHEMBL10013451 0.90 PDPK1 (0.50) PDPK1RAB9ACYP2A6LOXL2HSP90AA1
SCHEMBL10013455 0.90 PDPK1 (0.50) PDPK1RAB9ACYP2A6LOXL2HSP90AA1
SCHEMBL572750 0.86 PDPK1 (0.60) PDPK1RAB9ACYP2A6LOXL2MAPT
SCHEMBL10013456 0.83 PDPK1 (0.60) PDPK1RAB9ACYP2A6LOXL2PTGDR2
SCHEMBL13142475 0.82 PDPK1 (0.57) PDPK1RAB9ACYP2A6LOXL2HSP90AA1
SCHEMBL26259866 0.81 PDPK1 (0.55) PDPK1RAB9ACYP2A6LOXL2HSP90AA1
SCHEMBL10013463 0.80 PDPK1 (0.47) PDPK1RAB9ACYP2A6LOXL2HSP90AA1
SCHEMBL16159730 0.80 PDPK1 (0.49) PDPK1RAB9ACYP2A6LOXL2MAPT
SCHEMBL17704299 0.80 PDPK1 (0.45) PDPK1RAB9ACYP2A6LOXL2PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100341869-C Phenanthrene/thiophene hybridized high-mobility organic semiconductor and application thereof CHANGCHUN APPLIED CHEMISTRY (CN) 2007-10-10 CN disclosed
CN-1803792-A Phenanthrene/thiophene hybridized high-mobility organic semiconductor and application thereof CHANGCHUN APPLIED CHEMISTRY (CN) 2006-07-19 CN disclosed