SCHEMBL7949263

SCHEMBL7949263

COC(=O)c1cccc(C2=CCCCC2Cc2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.58
PTGIR P43119 4/20 0.58
PTGER1 P34995 1/20 0.58
PTGER3 P43115 1/20 0.50
KDM4E B2RXH2 3/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
NR4A2 P43354 10/20 0.43
RXRA P19793 5/20 0.41
RXRB P28702 4/20 0.41
NR4A1 P22736 3/20 0.41
NR4A3 Q92570 3/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RXRG P48443 3/20 0.40

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
SCHEMBL8129795 0.91 PTGER4 (0.52) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7959999 0.90 PTGER4 (0.70) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7964265 0.84 RXRA (0.52) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7960001 0.82 PTGIR (0.78) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL8129797 0.80 PTGER4 (0.47) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7961287 0.79 PTGER4 (0.61) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7949540 0.79 PTGER4 (0.69) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7964177 0.79 PTGIR (0.68) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7964171 0.79 PTGIR (0.73) PTGER4PTGIRPTGER1PTGER3KDM4E
SCHEMBL7961753 0.78 PTGER4 (0.69) PTGER4PTGIRPTGER1PTGER3KDM4E

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-6245790-B1 ANTIINFLAMMATORY AGENTS; GASTROINTESTINAL DISORDERS; SKN DISORDERS; BONE DISORDERS; MUSCLE RELAXANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-06-12 US disclosed