SCHEMBL5873987

SCHEMBL5873987

O=C(OC(O)CCCCO)OC(O)CCCCO

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
PTPN1 P18031 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
SCHEMBL22227762 0.98 GPR84 (0.36) GPR84FFAR1FFAR4PTPN1
SCHEMBL28264632 0.93 PTPN1 (0.32) PTPN1
SCHEMBL28409218 0.84 ACHE (0.38) GPR84FFAR1FFAR4
SCHEMBL28982642 0.84 GPR84 (0.36) GPR84FFAR1FFAR4PTPN1
SCHEMBL28938226 0.84 GPR84 (0.36) GPR84FFAR1FFAR4PTPN1
SCHEMBL3068283 0.82 THRB (0.41)
SCHEMBL20591182 0.82 PTPN1 (0.33) PTPN1
SCHEMBL194450 0.80 GPR84 (0.38) GPR84FFAR1FFAR4PTPN1
SCHEMBL7905079 0.79 MAPT (0.43) GPR84FFAR1FFAR4PTPN1
SCHEMBL8661638 0.79 MAPT (0.43) GPR84FFAR1FFAR4PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091302-B2 Process for the preparation of polycarbonate BAYER MATERIALSCIENCE AG (DE) 2006-08-15 US disclosed
US-20050239995-A1 Process for the preparation of polycarbonate BAYER MATERIALSCIENCE AG 2005-10-27 US disclosed
US-4191705-A Process for the preparation of carbonic acid esters of polyester-polyols BAYER AKTIENGESELLSCHAFT (DE) 1980-03-04 US disclosed
US-4191705-A Process for the preparation of carbonic acid esters of polyester-polyols BAYER AKTIENGESELLSCHAFT (DE) 1980-03-04 US disclosed