SCHEMBL20377486

SCHEMBL20377486

C=CCCCCCCOC=C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 2/20 0.48
LPAR2 Q9HBW0 1/20 0.48
TSHR P16473 3/20 0.46
MAPT P10636 2/20 0.39
ABCC4 O15439 1/20 0.39
ALDH1A1 P00352 5/20 0.39
LMNA P02545 3/20 0.39
TRPA1 O75762 2/20 0.37
SLC2A1 P11166 1/20 0.36
CDC25A P30304 1/20 0.33
USP2 O75604 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
HPGD P15428 1/20 0.31
CYP3A4 P08684 2/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNA1 P78396 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL5600496 1.00 LPAR3 (0.48) LPAR3LPAR2TSHRMAPTABCC4
SCHEMBL2770736 0.97
SCHEMBL2773072 0.89
SCHEMBL28163179 0.86
SCHEMBL9644644 0.86 ALDH1A1 (0.38) LPAR3LPAR2TSHRALDH1A1CDC25A
SCHEMBL3048726 0.86 ALDH1A1 (0.38) LPAR3LPAR2TSHRALDH1A1CDC25A
SCHEMBL18675767 0.86 ALDH1A1 (0.38) LPAR3LPAR2TSHRALDH1A1CDC25A
SCHEMBL22408792 0.86 ALDH1A1 (0.38) LPAR3LPAR2TSHRALDH1A1CDC25A
SCHEMBL9646107 0.86 ALDH1A1 (0.38) LPAR3LPAR2TSHRALDH1A1CDC25A
SCHEMBL18699067 0.86 ALDH1A1 (0.38) LPAR3LPAR2TSHRALDH1A1CDC25A

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
EP-3353224-A1 TWO-COMPONENT COATING COMPOUNDS BASF SE (DE) 2018-08-01 EP disclosed
EP-3347397-A1 WATER-EMULSIFIABLE ISOCYANATES WITH IMPROVED PROPERTIES BASF SE (DE) 2018-07-18 EP disclosed