SCHEMBL16610081

SCHEMBL16610081

COC(=O)CN(Cc1ccccn1)Cc1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
MAPT P10636 1/20 0.54
LIN28A Q9H9Z2 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 2/20 0.45
CYP1A2 P05177 1/20 0.45
TSHR P16473 1/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TRPM8 Q7Z2W7 1/20 0.44
KCNA5 P22460 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL29774122 1.00 SMN1; SMN2 (0.54) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL19889252 0.93 SMN1; SMN2 (0.63) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL15483878 0.89 SMN1; SMN2 (0.44) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL15483567 0.86 PGR (0.41) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL2393888 0.85 SMN1; SMN2 (0.51) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL8188478 0.83 SMN1; SMN2 (0.53) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL16626907 0.82 SMN1; SMN2 (0.59) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL1066335 0.80 SMN1; SMN2 (0.61) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL13688238 0.80 TRPM8 (0.52) SMN1; SMN2MAPTLIN28ATDP1ALDH1A1
SCHEMBL16626904 0.79 SMN1; SMN2 (0.59) SMN1; SMN2MAPTLIN28ATDP1KMT2A

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-9260663-B2 Liquid crystal composition, liquid crystal display, and method for producing liquid crystal display JSR CORPORATION (JP) 2016-02-16 US disclosed
US-20150092147-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY, AND METHOD FOR PRODUCING LIQUID CRYSTAL DISPLAY JSR CORPORATION (JP) 2015-04-02 US disclosed