SCHEMBL2138387

SCHEMBL2138387

CC(C)(c1ccccc1)c1cccc(OP(=O)(O)Oc2ccccc2)c1C(C)(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
SRC P12931 1/20 0.39
GPR84 Q9NQS5 1/20 0.37
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.33
ANPEP P15144 1/20 0.33
LAP3 P28838 1/20 0.33
LMNA P02545 1/20 0.33
PTPN5 P54829 1/20 0.32
PTPN1 P18031 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ESR1 P03372 1/20 0.32
CYP3A4 P08684 1/20 0.32
ESR2 Q92731 1/20 0.32

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
SCHEMBL9083115 0.83 GPR84 (0.41) ALDH1A1SRCGPR84POLBPTPN5
SCHEMBL30526475 0.82 ALDH1A1 (0.44) ALDH1A1SRCGPR84POLBL3MBTL1
SCHEMBL1819862 0.82 ALDH1A1 (0.44) ALDH1A1SRCGPR84POLBL3MBTL1
SCHEMBL6891159 0.79 ALDH1A1 (0.48) ALDH1A1SRCGPR84POLBL3MBTL1
SCHEMBL31684848 0.79 ALDH1A1 (0.48) ALDH1A1SRCGPR84POLBL3MBTL1
SCHEMBL1900143 0.77 ALDH1A1 (0.50) ALDH1A1SRCPOLBLMNATDP1
SCHEMBL3693240 0.77 SRC (0.52) ALDH1A1SRCPOLBLMNAESR1
SCHEMBL2131617 0.76 ALDH1A1 (0.41) ALDH1A1SRCGPR84POLBL3MBTL1
SCHEMBL245087 0.76 ATM (0.37) ALDH1A1POLBL3MBTL1TDP1ESR1
SCHEMBL6544825 0.75 ALDH1A1 (0.48) ALDH1A1SRCPOLBLMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150065622-A1 STABILIZED POLYCARBONATE/ACRYLONITRILE/STYRENE/ACRYLIC ESTER MOULDING COMPOUNDS Styrolution GmbH (DE) 2015-03-05 US disclosed
US-7863377-B2 Thermoplastic molding materials based on polyesters and styrene copolymers BASF AG (DE) 2011-01-04 US disclosed
US-20080227920-A1 Thermoplastic Molding Materials Based on Polyesters and Styrene Copolymers BASF AKTIENGESELLSCHAFT (DE) 2008-09-18 US disclosed