SCHEMBL2554848

SCHEMBL2554848

C=CC(=O)NC(CC)CP(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.44
MMP2 P08253 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MMP8 P22894 1/20 0.44
CA9 Q16790 1/20 0.44
TSHR P16473 2/20 0.44
LAP3 P28838 1/20 0.36
MMP3 P08254 1/20 0.35
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
TAS1R3 Q7RTX0 2/20 0.32
TAS1R1 Q7RTX1 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL2558578 0.86 TAS1R3 (0.44) MMP1MMP2CA12CA1CA2
SCHEMBL2552685 0.83 FDPS (0.42) TSHRLAP3ZDHHC20ZDHHC2TAS1R3
SCHEMBL5170699 0.82 TSHR (0.56) MMP1MMP2CA12CA1CA2
SCHEMBL14937763 0.82 FDPS (0.43) TSHRLAP3ZDHHC20ZDHHC2FNTA
SCHEMBL25250018 0.79 TSHR (0.52) MMP1MMP2CA12CA1CA2
SCHEMBL28647039 0.78 CA12 (0.41) MMP1MMP2CA12CA1CA2
SCHEMBL5177219 0.78 TSHR (0.52) MMP1MMP2CA12CA1CA2
SCHEMBL8384172 0.78 TSHR (0.47) MMP1MMP2CA12CA1CA2
SCHEMBL21909974 0.77 TSHR (0.50) MMP1MMP2CA12CA1CA2
SCHEMBL2938364 0.77 TSHR (0.50) MMP1MMP2CA12CA1CA2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9493598-B2 Polymers having acid and amide moieties, and uses thereof ISP INVESTMENTS LLC (US) 2016-11-15 US claimed
US-20130123147-A1 POLYMERS HAVING ACID AND AMIDE MOIETIES, AND USES THEREOF ISP INVESTMENTS INC. (US) 2013-05-16 US claimed
WO-2011130370-A1 POLYMERS HAVING ACID AND AMIDE MOIETIES, AND USES THEREOF ISP INVESTMENTS INC. (US) 2011-10-20 WO claimed
CN-112745464-A Phosphate-containing high-adaptability early-strength polycarboxylate superplasticizer and preparation method and application thereof 广州市建筑科学研究院有限公司 2021-05-04 CN disclosed
US-9493598-B2 Polymers having acid and amide moieties, and uses thereof ISP INVESTMENTS LLC (US) 2016-11-15 US disclosed
US-20130123147-A1 POLYMERS HAVING ACID AND AMIDE MOIETIES, AND USES THEREOF ISP INVESTMENTS INC. (US) 2013-05-16 US disclosed