SCHEMBL23764901

SCHEMBL23764901

CCCc1c(C)c(F)c(F)c(C)c1F

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TAS1R2 Q8TE23 1/20 0.31

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
SCHEMBL13983453 0.90
SCHEMBL23720718 0.87 ALDH1A1 (0.30) KDM4EALDH1A1HPGDTAS1R3TAS1R1
SCHEMBL18134993 0.86 TAS1R3 (0.32) ALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL22561839 0.84
SCHEMBL22931572 0.81
SCHEMBL21260544 0.78
SCHEMBL14528422 0.78
SCHEMBL26375129 0.74 TAS1R3 (0.38) KDM4EHPGDTAS1R3TAS1R1TAS1R2
SCHEMBL16575391 0.74 KDM4E (0.32) KDM4EALDH1A1HPGD
SCHEMBL172098 0.71 SLC6A2 (0.31) KDM4EALDH1A1HPGD

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-3865544-A1 FLUORESCENT RHODAMINE DYES WITH ENHANCED CELL PERMEABILITY Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2021-08-18 EP disclosed