SCHEMBL16707486

SCHEMBL16707486

Cc1c(C)c(SC(F)(F)F)c(C)c(C)c1SC(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL16707490 0.97 HTR2A (0.31) HTR2A
SCHEMBL13725004 0.78 KDM4E (0.36) HTR2AKDM4EALDH1A1TDP1
SCHEMBL16707487 0.74 HTR2A (0.32) HTR2A
SCHEMBL7477600 0.68 HTR2A (0.31) HTR2A
SCHEMBL16707484 0.68 SMN1; SMN2 (0.41) HTR2AKDM4EALDH1A1TDP1
SCHEMBL16707489 0.67 ALDH1A1 (0.37) HTR2AKDM4EALDH1A1TDP1
SCHEMBL21614301 0.66 SMN1; SMN2 (0.33) HTR2AKDM4EALDH1A1TDP1
SCHEMBL13724955 0.65 KDM4E (0.40) HTR2AKDM4EALDH1A1TDP1
SCHEMBL13724789 0.65 LMNA (0.31)
SCHEMBL16707603 0.64 SMN1; SMN2 (0.42) KDM4EALDH1A1TDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9647218-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-05-09 US disclosed
US-20150129849-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-05-14 US disclosed