SCHEMBL9305321

SCHEMBL9305321

C=C(C)C(=O)OC(CCO)CCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
FAAH O00519 1/20 0.40
GPR84 Q9NQS5 5/20 0.38
PRKCA P17252 3/20 0.38
FFAR1 O14842 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.38
LMNA P02545 1/20 0.37
LCK P06239 1/20 0.37
PPARD Q03181 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCD Q05655 1/20 0.36

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
SCHEMBL18762136 1.00 TSHR (0.50) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL7179762 0.98 TSHR (0.47) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL17222845 0.95 TSHR (0.49) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL478186 0.95 TSHR (0.55) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL21853813 0.95 TSHR (0.55) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL2725427 0.95 TSHR (0.55) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL21853809 0.95 TSHR (0.55) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL21647274 0.95 TSHR (0.55) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL6679717 0.95 TSHR (0.55) TSHRMAPTMAPK1FAAHGPR84
SCHEMBL886833 0.95 TSHR (0.55) TSHRMAPTMAPK1FAAHGPR84

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-5294401-A Blood gas exchange TERUMO KABUSHIKI KAISHA (JP) 1994-03-15 US disclosed
EP-0354959-B1 MEMBRANE TYPE ARTIFICIAL LUNG AND PRODUCTION THEREOF TERUMO KABUSHIKI KAISHA (JP) 1993-01-20 EP disclosed
EP-0354959-A1 MEMBRANE TYPE ARTIFICIAL LUNG AND PRODUCTION THEREOF TERUMO KABUSHIKI KAISHA (JP) 1990-02-21 EP disclosed