SCHEMBL13197262

SCHEMBL13197262

CC1C(C)C2CC1[C@@H](C(=O)OCc1ccccc1)[C@H]2C(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 4/20 0.54
FABP5 Q01469 4/20 0.54
ALDH1A1 P00352 3/20 0.50
TSHR P16473 1/20 0.50
HTR2C P28335 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
SLC6A3 Q01959 2/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SLC6A2 P23975 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CPB1 P15086 1/20 0.43

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
SCHEMBL31145528 0.85 FABP7 (0.61) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL14827596 0.81 FABP7 (0.48) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL22807598 0.80 ALDH1A1 (0.46) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL14827594 0.79 ALDH1A1 (0.48) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL14827592 0.79 ALDH1A1 (0.48) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL14828644 0.79 FABP7 (0.46) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL15080525 0.79 FABP7 (0.58) FABP7FABP5ALDH1A1TSHRSLC6A3
SCHEMBL1838938 0.79 ALDH1A1 (0.55) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL1838935 0.79 ALDH1A1 (0.55) FABP7FABP5ALDH1A1TSHRHTR2C
SCHEMBL14827593 0.79 FABP7 (0.55) FABP7FABP5ALDH1A1TSHRHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100210803-A1 NORBORNENE-BASED POLYMER HAVING LOW DIELECTRIC CONSTANT AND LOW-LOSS PROPERTIES AND INSULATING MATERIAL USING THE SAME SAMSUNG ELECTRO-MECHANICS CO., LTD. 2010-08-19 US disclosed