SCHEMBL19788645

SCHEMBL19788645

CC(C)(C)NCCCC[C@H](NC(=O)NC(=O)O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 18/20 0.47
▸ RIMKLA Q8IXN7 1/20 0.39
▸ NAALAD2 Q9Y3Q0 1/20 0.39
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 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
SCHEMBL9912229 0.84 FOLH1 (0.68) FOLH1RIMKLANAALAD2
SCHEMBL18253629 0.84 FOLH1 (0.68) FOLH1RIMKLANAALAD2
SCHEMBL24123152 0.84 FOLH1 (0.68) FOLH1RIMKLANAALAD2
SCHEMBL20910851 0.82 FOLH1 (0.66) FOLH1RIMKLANAALAD2
SCHEMBL26757838 0.82 FOLH1 (0.58) FOLH1RIMKLANAALAD2
SCHEMBL13884310 0.80 FOLH1 (0.40) FOLH1ITGB3ITGA2B
SCHEMBL13893519 0.80 FOLH1 (0.40) FOLH1ITGB3ITGA2B
SCHEMBL26757300 0.79 FOLH1 (0.65) FOLH1RIMKLANAALAD2
SCHEMBL14450667 0.79 FOLH1 (0.40) FOLH1NAALAD2ITGB3ITGA2B
SCHEMBL18272834 0.79 FOLH1 (0.40) FOLH1ITGB3ITGA2B

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
US-9872913-B2 Drug loaded polymeric nanoparticles and methods of making and using same PFIZER INC. (US) 2018-01-23 — — US disclosed
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