SCHEMBL762277

SCHEMBL762277

COC(Nc1nc(N)nc(N)n1)(OC)OC.Nc1nc(NCO)nc(N(CO)CO)n1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL63308 0.93 ALDH1A1 (0.33) ALDH1A1
Hexamethylolmelamine SCHEMBL762278 0.86 ALDH1A1 (0.33) ALDH1A1
SCHEMBL62549 0.84 ALDH1A1 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL11651773 0.83 ALDH1A1 (0.34) ALDH1A1
SCHEMBL11816505 0.81 CYP1A2 (0.32)
SCHEMBL28223407 0.81 GPR68 (0.33)
SCHEMBL11319118 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL5092522 0.80 ALDH1A1 (0.34) ALDH1A1
Formaldehyde SCHEMBL8433631 0.80 ALDH1A1 (0.35) ALDH1A1
Bicarbonate SCHEMBL9652070 0.79 ALDH1A1 (0.35) ALDH1A1

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-1452309-B1 ADHESIVE POLYESTER FILM FOR OPTICAL USE TEIJIN DUPONT FILMS JAPAN LTD (JP) 2012-03-21 EP disclosed