SCHEMBL3687139

SCHEMBL3687139

CC(c1ccccc1-c1ccccc1)C(C)(OP(=O)(O)Oc1ccccc1)c1ccccc1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
GPR84 Q9NQS5 1/20 0.36
BTN3A1 O00481 11/20 0.36
POLB P06746 1/20 0.36
SRC P12931 1/20 0.36
ANPEP P15144 1/20 0.35
LAP3 P28838 1/20 0.35
PPARA Q07869 2/20 0.33
PPARG P37231 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
SCHEMBL3677513 0.80 ALDH1A1 (0.41) ALDH1A1GPR84BTN3A1POLBSRC
SCHEMBL3684217 0.80 GPR84 (0.43) ALDH1A1GPR84BTN3A1POLBSRC
SCHEMBL231066 0.74 SRC (0.43) ALDH1A1GPR84BTN3A1POLBSRC
SCHEMBL231552 0.74 ALDH1A1 (0.45) ALDH1A1GPR84POLBSRCANPEP
SCHEMBL3676483 0.74 ALDH1A1 (0.41) ALDH1A1GPR84BTN3A1POLBSRC
SCHEMBL3691892 0.73 PTPN5 (0.42) ALDH1A1POLBSRCANPEPLAP3
SCHEMBL3686897 0.73 ALDH1A1 (0.40) ALDH1A1GPR84BTN3A1POLBSRC
Biphenyl SCHEMBL190156 0.72 SRC (0.50) ALDH1A1GPR84POLBSRCANPEP
SCHEMBL3676332 0.70 ALDH1A1 (0.44) ALDH1A1GPR84BTN3A1POLBSRC
SCHEMBL525387 0.70 SRC (0.55) ALDH1A1POLBSRCANPEPLAP3

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
US-20100168299-A1 Flame-Retardant Polyester Fibers and Preparation Process Thereof DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-07-01 US disclosed
EP-1857586-A1 FLAME-RETARDANT POLYESTER FIBER AND METHOD FOR PRODUCING SAME DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2007-11-21 EP disclosed