SCHEMBL3326446

SCHEMBL3326446

c1ccc(-n2c3ccccc3c3ccccc32)c(-c2cccc3cc4ccc5cc6ccccc6cc5c4cc23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
HSD17B10 Q99714 5/20 0.40
HIF1A Q16665 3/20 0.40
CYP1B1 Q16678 1/20 0.40
HPGD P15428 3/20 0.39
CYP1A2 P05177 2/20 0.39
GSR P00390 1/20 0.35
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ATM Q13315 1/20 0.34
CASP1 P29466 3/20 0.34
ACHE P22303 2/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 2/20 0.34
ERBB2 P04626 1/20 0.34
FYN P06241 1/20 0.34
MAOA P21397 1/20 0.34
AHR P35869 1/20 0.34
TUBB4A P04350 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
SCHEMBL18566800 0.91 ALDH1A1 (0.39) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL18566807 0.89 ALDH1A1 (0.39) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL3329263 0.85 CYP2A6 (0.38) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL20227546 0.85 TDP1 (0.51) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL18566830 0.84 TDP1 (0.41) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL28744945 0.82 GSR (0.46) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL8780742 0.81 ALDH1A1 (0.51) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL18566806 0.80 TDP1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL24326550 0.80 L3MBTL1 (0.45) ALDH1A1HSD17B10HIF1ACYP1B1HPGD
SCHEMBL8780739 0.80 TDP1 (0.50) ALDH1A1HSD17B10HIF1ACYP1B1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461282-B2 (Pentaphenyl)phenyl group containing compound, polymeric derivative thereof and method for forming the same NATIONAL TAIWAN UNIVERSITY (TW) 2013-06-11 US claimed
US-20100137461-A1 (Pentaphenyl)phenyl Group Containing Compound, Polymeric Derivative Thereof And Method For Forming The Same NATIONAL TAIWAN UNIVERSITY (TW) 2010-06-03 US claimed
US-20080293945-A1 (Pentaphenyl)phenyl Group Containing Compound, Polymeric Derivative Thereof And Method For Forming The Same NATIONAL TAIWAN UNIVERSITY (TW) 2008-11-27 US claimed
US-8461282-B2 (Pentaphenyl)phenyl group containing compound, polymeric derivative thereof and method for forming the same NATIONAL TAIWAN UNIVERSITY (TW) 2013-06-11 US disclosed
US-8461282-B2 (Pentaphenyl)phenyl group containing compound, polymeric derivative thereof and method for forming the same NATIONAL TAIWAN UNIVERSITY (TW) 2013-06-11 US disclosed
US-20100137461-A1 (Pentaphenyl)phenyl Group Containing Compound, Polymeric Derivative Thereof And Method For Forming The Same NATIONAL TAIWAN UNIVERSITY (TW) 2010-06-03 US disclosed
US-20100137461-A1 (Pentaphenyl)phenyl Group Containing Compound, Polymeric Derivative Thereof And Method For Forming The Same NATIONAL TAIWAN UNIVERSITY (TW) 2010-06-03 US disclosed
US-20080293945-A1 (Pentaphenyl)phenyl Group Containing Compound, Polymeric Derivative Thereof And Method For Forming The Same NATIONAL TAIWAN UNIVERSITY (TW) 2008-11-27 US disclosed
US-20080293945-A1 (Pentaphenyl)phenyl Group Containing Compound, Polymeric Derivative Thereof And Method For Forming The Same NATIONAL TAIWAN UNIVERSITY (TW) 2008-11-27 US disclosed