SCHEMBL26626499

SCHEMBL26626499

NC[C@H]1CC[C@H](OC(=O)C(F)(F)F)CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.42
PLAT P00750 1/20 0.42
LMNA P02545 1/20 0.42
TPSAB1 Q15661 1/20 0.38
TPSD1 Q9BZJ3 1/20 0.38
TPSG1 Q9NRR2 1/20 0.38
CYP2D6 P10635 1/20 0.33
F2 P00734 1/20 0.30

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
SCHEMBL20240947 1.00 PLG (0.42) PLGPLATLMNATPSAB1TPSD1
SCHEMBL1958023 0.87 NAAA (0.31)
Hydrazine SCHEMBL22505628 0.84 GPR35 (0.33)
SCHEMBL398217 0.84 GPR35 (0.34)
SCHEMBL13888375 0.80 TPSAB1 (0.38) PLGPLATLMNATPSAB1TPSD1
SCHEMBL17911018 0.79 F2 (0.33) F2
SCHEMBL4269678 0.79 F2 (0.33) F2
SCHEMBL19924308 0.78 PLG (0.50) PLGPLATLMNATPSAB1TPSD1
SCHEMBL6746634 0.77 CYP19A1 (0.41)
SCHEMBL9505982 0.76 PLG (0.54) PLGPLATLMNATPSAB1TPSD1

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-2699553-B1 SUBSTITUTED DIAMINOCARBOXAMIDE AND DIAMINOCARBONITRILE PYRIMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARM LLC (US) 2023-11-08 EP disclosed