SCHEMBL9064784

SCHEMBL9064784

C=Cc1ccccc1COC(F)(F)CF

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
IDO1 P14902 2/20 0.33

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
SCHEMBL21156386 0.79 ALDH1A1 (0.36) ALDH1A1
SCHEMBL8600599 0.78 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8621297 0.76 IDO1 (0.36) ALDH1A1IDO1
SCHEMBL252296 0.75 ALDH1A1 (0.43) ALDH1A1IDO1
SCHEMBL8623549 0.73 ALDH1A1 (0.32) ALDH1A1IDO1
SCHEMBL167518 0.73 ALDH1A1 (0.44) ALDH1A1
SCHEMBL30548396 0.73 ALDH1A1 (0.44) ALDH1A1
SCHEMBL13592490 0.72 ALDH1A1 (0.40) ALDH1A1
SCHEMBL58238 0.72 ALDH1A1 (0.40) ALDH1A1IDO1
SCHEMBL7792761 0.72 ALDH1A1 (0.40) 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
US-5556929-A FROM UNSATURATED DIESTER WITH URETHANE AND FLUORINE GROUPS AND ACRYLATED SILOXANE, CONTACT LENSES MENICON CO., LTD. (JP) 1996-09-17 US disclosed