SCHEMBL10752111

SCHEMBL10752111

CCCCCCCCCCCC#Cc1cccc(C=C(C(=O)O)C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
MMP2 P08253 1/20 0.46
MMP12 P39900 1/20 0.46
KCNH2 Q12809 1/20 0.42
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
GGPS1 O95749 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.37
PTPN7 P35236 2/20 0.37
GPR84 Q9NQS5 1/20 0.37

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
SCHEMBL10796653 0.85 FFAR1 (0.48) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL10796659 0.82 FFAR1 (0.46) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL8846233 0.81 GGPS1 (0.44) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL8846716 0.81 GGPS1 (0.44) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL1852576 0.81 KCNH2 (0.48) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL10795164 0.81 KCNH2 (0.48) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL7680519 0.81 KCNH2 (0.48) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL8846088 0.81 KCNH2 (0.48) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL9700186 0.80 KCNH2 (0.45) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL9150614 0.78 NR1I2 (0.52) FFAR1FFAR4MMP2MMP12KCNH2

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-0195097-B1 ARACHIDONIC ACID ANALOGUES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN MEDICINE BEECHAM GROUP PLC (GB) 1987-10-28 EP claimed
US-4699995-A ANTIALLERGENS BEECHAM GROUP P.L.C. (GB) 1987-10-13 US claimed
EP-0142145-B1 ARACHIDONIC ACID ANALOGUES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN MEDICINE BEECHAM GROUP PLC (GB) 1987-03-04 EP claimed
EP-0195097-A1 Arachidonic acid analogues, processes for their preparation and their use in medicine BEECHAM GROUP PLC (GB) 1986-09-24 EP claimed
EP-0142145-A2 Arachidonic acid analogues, processes for their preparation and their use in medicine BEECHAM GROUP PLC (GB) 1985-05-22 EP claimed