SCHEMBL8086435

SCHEMBL8086435

CCC(C)Oc1ccccc1CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.46
AKR1B1 P15121 1/20 0.46
CHRM1 P11229 1/20 0.44
CFD P00746 2/20 0.43
F11 P03951 2/20 0.43
TPSB2 P20231 2/20 0.43
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CAMK2A Q9UQM7 2/20 0.41
LTB4R Q15722 3/20 0.40
LTB4R2 Q9NPC1 3/20 0.40
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40
MMP12 P39900 1/20 0.40
MMP13 P45452 1/20 0.40
MMP14 P50281 1/20 0.40
MMP16 P51512 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 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
SCHEMBL24200105 1.00 CXCL8 (0.50) CXCL8L3MBTL1AKR1B1CHRM1CFD
SCHEMBL10343471 0.86 MTNR1A (0.39) CXCL8L3MBTL1MAPTMTNR1AMTNR1B
SCHEMBL3941649 0.85 CXCL8 (0.54) CXCL8L3MBTL1AKR1B1CHRM1CFD
SCHEMBL23229157 0.85 CXCL8 (0.54) CXCL8L3MBTL1AKR1B1CHRM1CFD
SCHEMBL19840604 0.84 MTNR1A (0.44) L3MBTL1MAPTMTNR1AMTNR1B
SCHEMBL21455171 0.84 CXCL8 (0.48) CXCL8L3MBTL1AKR1B1CHRM1CFD
SCHEMBL8998039 0.83 CXCL8 (0.47) CXCL8L3MBTL1AKR1B1CHRM1CFD
SCHEMBL23425588 0.83 TBXAS1 (0.47) L3MBTL1MAPT
SCHEMBL23656617 0.83 TSHR (0.51) L3MBTL1MAPTTDP1MTNR1AMTNR1B
SCHEMBL23241478 0.83 TBXAS1 (0.47) L3MBTL1MAPT

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
EP-3939658-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-01-19 EP disclosed
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed