SCHEMBL295805

SCHEMBL295805

Cc1cn(OC(CO)CF)c([N+](=O)[O-])n1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MITF O75030 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL10386779 0.78 MITF (0.39) MITFALDH1A1
SCHEMBL295235 0.77 POLB (0.39) ALDH1A1
SCHEMBL7551286 0.76 MITF (0.36) MITFALDH1A1
SCHEMBL295804 0.63 LMNA (0.45) ALDH1A1
SCHEMBL29612990 0.63 LMNA (0.45) ALDH1A1
SCHEMBL28888792 0.63 MITF (0.51) MITFALDH1A1
SCHEMBL3835022 0.61 MITF (0.52) MITFALDH1A1
SCHEMBL6131588 0.59 MITF (0.44) MITFALDH1A1
SCHEMBL17186456 0.59 MITF (0.40) MITFALDH1A1
SCHEMBL5050584 0.56 LMNA (0.49) MITFALDH1A1

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-2128140-B1 METHOD FOR PRODUCING 2-NITROIMIDAZOLE DERIVATIVE POLA PHARMA INC (JP) 2012-03-14 EP disclosed