SCHEMBL8977599

SCHEMBL8977599

CC(=O)N[C@@H](Cc1ccc(OC(=O)[C@H](Cc2ccc(O)cc2)NC(C)=O)cc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.56
ITGA2B P08514 2/20 0.56
FOLH1 Q04609 1/20 0.53
MME P08473 4/20 0.52
ACE P12821 3/20 0.52
CPA1 P15085 1/20 0.52
ACE2 Q9BYF1 1/20 0.52
NAALAD2 Q9Y3Q0 1/20 0.50
LMNA P02545 1/20 0.50
TSHR P16473 1/20 0.49
TACR1 P25103 1/20 0.49
PPARG P37231 2/20 0.48
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LNPEP Q9UIQ6 1/20 0.46
MDM4 O15151 1/20 0.46
MDM2 Q00987 1/20 0.46

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
SCHEMBL16909929 0.91 SLC7A5 (0.58) ITGB3ITGA2BFOLH1TSHRTACR1
SCHEMBL11043757 0.91 TSHR (0.59) ITGB3ITGA2BCPA1TSHRTACR1
SCHEMBL11043759 0.91 TSHR (0.59) ITGB3ITGA2BCPA1TSHRTACR1
Acetyl Tyrosine SCHEMBL321220 0.87 FOLH1 (0.66) ITGB3ITGA2BFOLH1MMEACE
Acetyl Tyrosine SCHEMBL1204300 0.87 FOLH1 (0.66) ITGB3ITGA2BFOLH1MMEACE
Acetyl Tyrosine SCHEMBL8977600 0.87 FOLH1 (0.66) ITGB3ITGA2BFOLH1MMEACE
Acetyl Tyrosine SCHEMBL8977601 0.87 FOLH1 (0.66) ITGB3ITGA2BFOLH1MMEACE
Acetyl Tyrosine SCHEMBL313539 0.87 FOLH1 (0.66) ITGB3ITGA2BFOLH1MMEACE
Acetyl Tyrosine SCHEMBL3391732 0.86 FOLH1 (0.64) ITGB3ITGA2BFOLH1MMEACE
Acetyl Tyrosine SCHEMBL8845209 0.86 FOLH1 (0.64) ITGB3ITGA2BFOLH1MMEACE

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
EP-0707844-A2 Liposome delivery of compositions to enhance tanning and repair UV damage CALIFORNIA SUNCARE INC. (US) 1996-04-24 EP claimed