SCHEMBL21851606

SCHEMBL21851606

CC1(F)C(F)(F)C2(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C2(F)C2(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C12F

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL17831505 0.93 MEN1 (0.61) MEN1KMT2ATDP1
SCHEMBL10706294 0.90 MEN1 (0.57) MEN1KMT2ATDP1
SCHEMBL9451902 0.90 MEN1 (0.57) MEN1KMT2ATDP1
SCHEMBL11613184 0.80 MEN1 (0.44) MEN1KMT2ATDP1
SCHEMBL145943 0.78 MEN1 (0.89) MEN1KMT2ATDP1
SCHEMBL18979331 0.78 MEN1 (0.89) MEN1KMT2ATDP1
Perflunafene SCHEMBL21916758 0.78 MEN1 (0.89) MEN1KMT2ATDP1
SCHEMBL18496402 0.76 MEN1 (0.47) MEN1KMT2ATDP1
SCHEMBL328090 0.76 MEN1 (0.38) MEN1KMT2ATDP1
SCHEMBL24732508 0.73 MEN1 (0.39) MEN1KMT2ATDP1

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-3027322-B1 METHOD FOR SORTING CELLS AND/OR PARTICLES SPHERE FLUIDICS LTD (GB) 2020-04-08 EP disclosed