SCHEMBL9770489

SCHEMBL9770489

C[C@H](O)CCC[C@H](O)CCCCCc1cccc(OCc2ccccc2)c1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.58
PTGER4 P35408 5/20 0.48
PTGER3 P43115 5/20 0.48
PTGER2 P43116 5/20 0.48
PTGER1 P34995 4/20 0.48
PPARA Q07869 2/20 0.47
PPARG P37231 1/20 0.46
MGLL Q99685 1/20 0.46
BID P55957 1/20 0.44
BCL2L1 Q07817 1/20 0.44
MCL1 Q07820 1/20 0.44
BAK1 Q16611 1/20 0.44
ACLY P53396 1/20 0.44
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41

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
SCHEMBL9770494 1.00 FOLH1 (0.58) FOLH1PTGER4PTGER3PTGER2PTGER1
SCHEMBL28474342 0.81 FOLH1 (0.70) FOLH1PTGER4PTGER3PTGER2PTGER1
SCHEMBL9770508 0.79 BID (0.63) PPARAPPARGBIDBCL2L1MCL1
SCHEMBL9770506 0.79 BID (0.63) PPARAPPARGBIDBCL2L1MCL1
SCHEMBL9770567 0.78 LTB4R (0.51) MCL1ACLY
SCHEMBL9770571 0.78 LTB4R (0.51) MCL1ACLY
SCHEMBL9770477 0.75 SLC16A3 (0.48) FOLH1
SCHEMBL9770470 0.75 SLC16A3 (0.48) FOLH1
SCHEMBL4379752 0.74 FOLH1 (1.00) FOLH1PTGER4PTGER3PTGER2PTGER1
SCHEMBL15080959 0.73 HTR1A (0.65) PTGER4PTGER3PTGER2PTGER1MGLL

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-5041610-A Resorcyclic acid lactone derivatives as animal growth promotants INTERNATIONAL MINERALS & CHEMICAL CORP. (US) 1991-08-20 US disclosed