SCHEMBL10364307

SCHEMBL10364307

C=CCCCCCCCCCO[C]=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 2/20 0.48
LPAR2 Q9HBW0 1/20 0.48
TSHR P16473 3/20 0.41
MAPT P10636 3/20 0.40
ABCC4 O15439 1/20 0.40
ALDH1A1 P00352 6/20 0.39
LMNA P02545 2/20 0.39
TRPA1 O75762 3/20 0.38
SLC2A1 P11166 1/20 0.33
CYP3A4 P08684 3/20 0.32
USP2 O75604 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
RECQL P46063 1/20 0.32
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL3042205 1.00 LPAR3 (0.48) LPAR3LPAR2TSHRMAPTABCC4
SCHEMBL4300522 1.00 LPAR3 (0.48) LPAR3LPAR2TSHRMAPTABCC4
SCHEMBL95153 0.98
SCHEMBL96094 0.91
SCHEMBL98184 0.80
SCHEMBL7116385 0.74
SCHEMBL3024776 0.74 LPAR2 (0.34) LPAR3LPAR2MAPTLMNAUSP2
SCHEMBL3038091 0.74 LPAR2 (0.34) LPAR3LPAR2MAPTLMNAUSP2
SCHEMBL153995 0.73
SCHEMBL2286288 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0207097-B1 NEW CARBONIC ACID ESTERS CIBA-GEIGY AG (CH) 1990-08-08 EP disclosed
US-4764523-A Novel carbonic acid esters CIBA-GEIGY CORPORATION (US) 1988-08-16 US disclosed
EP-0207097-A1 NEW CARBONIC ACID ESTERS. CIBA GEIGY AG (CH) 1987-01-07 EP disclosed
WO-1986003747-A1 NEW CARBONIC ACID ESTERS CIBA-GEIGY AG (CH) 1986-07-03 WO disclosed
US-4202816-A ENOL-PIPERIDINE METAL COMPLEXES CIBA-GEIGY CORPORATION (US) 1980-05-13 US disclosed