SCHEMBL8718703

SCHEMBL8718703

CCCC(CC(=O)O)P(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.48
METAP1 P53582 2/20 0.45
FOLH1 Q04609 2/20 0.42
GPR84 Q9NQS5 4/20 0.39
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL2982665 0.87 FDPS (0.43) FDPSMETAP1FOLH1GPR84CHRM1
SCHEMBL9486364 0.84 GPR84 (0.56) FDPSGPR84
SCHEMBL9485772 0.84 GPR84 (0.56) FDPSGPR84
SCHEMBL15068281 0.84 GPR84 (0.56) FDPSGPR84
Butane SCHEMBL7715957 0.83 FOLH1 (0.42) FDPSMETAP1FOLH1GPR84TDP1
SCHEMBL8781578 0.82 FOLH1 (0.45) FDPSMETAP1FOLH1TDP1
SCHEMBL9461885 0.81 FOLH1 (0.52) FOLH1TDP1
SCHEMBL3889795 0.81 FDPS (0.62) FDPSMETAP1
SCHEMBL2987753 0.81 GPR84 (0.38) FDPSMETAP1FOLH1GPR84CHRM1
SCHEMBL11227702 0.80 FOLH1 (0.43) FOLH1TDP1

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-0687319-B1 A PROCESS FOR PROVIDING LOCALIZED VARIATION IN THE COLOUR DENSITY OF FABRICS NOVO NORDISK AS (DK) 1998-06-10 EP claimed
CN-110433327-B Bone repair material and preparation method thereof 中国科学院深圳先进技术研究院 2021-11-30 CN disclosed
CN-112516382-A Photothermal anti-tumor and bone-promoting composite material and preparation method thereof 中国科学院深圳先进技术研究院 2021-03-19 CN disclosed
CN-110433327-A A kind of bone renovating material and preparation method thereof SHENZHEN INST OF ADV TECH CAS 2019-11-12 CN disclosed