SCHEMBL21074254

SCHEMBL21074254

Cc1ccc2c(oc3ccccc32)c1N1c2ncccc2N(c2ccccc2)C1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.33
MAPT P10636 5/20 0.33
HSD17B10 Q99714 4/20 0.33
MEN1 O00255 3/20 0.33
HTT P42858 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPK1 P28482 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HCRTR1 O43613 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
ALDH1A1 P00352 1/20 0.32
NPY1R P25929 1/20 0.32
NPY2R P49146 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 3/20 0.31
DRD4 P21917 1/20 0.30
NPC1 O15118 2/20 0.30
USP2 O75604 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
SCHEMBL20349234 1.00 TSHR (0.33) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL19999704 1.00 TSHR (0.33) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL20349237 0.96 TSHR (0.33) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL21074251 0.91 TSHR (0.32) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL19999698 0.91 TSHR (0.32) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL19999707 0.90 TSHR (0.34) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL21074292 0.90 TSHR (0.34) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL19224781 0.90 TSHR (0.35) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL19258090 0.90 TSHR (0.35) TSHRMAPTHSD17B10MEN1HTT
SCHEMBL19258253 0.90 TSHR (0.35) TSHRMAPTHSD17B10MEN1HTT

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
EP-3492480-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-10-20 EP disclosed
EP-3492480-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2019-06-05 EP disclosed