SCHEMBL16716728

SCHEMBL16716728

Cc1ccc2c(oc3ccccc32)c1N1c2cccnc2N(C(C)C)[C@H]1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
HSD17B10 Q99714 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
MAPK1 P28482 1/20 0.31
NPY1R P25929 1/20 0.31
HTT P42858 1/20 0.31
NPY2R P49146 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
NCOA1 Q15788 2/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
CYP1B1 Q16678 1/20 0.31
TLR7 Q9NYK1 1/20 0.30

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
SCHEMBL20349239 1.00 TSHR (0.33) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL21468819 1.00 TSHR (0.33) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL16716695 0.92 TSHR (0.33) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL21074296 0.92 TSHR (0.33) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL20349241 0.92 TSHR (0.33) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL21074289 0.89 TSHR (0.34) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL20349242 0.89 TSHR (0.34) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL19999696 0.89 TSHR (0.34) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL16727559 0.89 TSHR (0.31) TSHRTLR7
SCHEMBL20349250 0.88 CYP1A2 (0.31) CYP1A2CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9905784-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-02-27 US disclosed
US-9905784-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-02-27 US disclosed
EP-3220440-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2017-09-20 EP disclosed
EP-2874195-B1 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORP (US) 2017-05-03 EP disclosed
US-20150137095-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2015-05-21 US disclosed
US-20150137095-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2015-05-21 US disclosed
EP-2874195-A2 Organic eletroluminescent materials and devices Universal Display Corporation (US) 2015-05-20 EP disclosed