SCHEMBL16683252

SCHEMBL16683252

Cc1ccc2sc3ccc(N(c4ccccc4)c4cc5c6ccccc6c(N(c6ccccc6)c6ccc7sc8ccccc8c7c6)cc5c5ccccc45)cc3c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.36
PTPN7 P35236 1/20 0.34
DUSP3 P51452 1/20 0.34
PTPN12 Q05209 1/20 0.34
PTPN22 Q9Y2R2 1/20 0.34
CYP1A2 P05177 1/20 0.33
DHODH Q02127 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRE P78334 1/20 0.33
GABRA6 Q16445 1/20 0.33

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
SCHEMBL21261400 0.97 KDM1A (0.32) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL12206586 0.96 GPR3 (0.35) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL12206581 0.92 GPR3 (0.42) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL12206589 0.91 GPR3 (0.37) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL18159296 0.90 GPR3 (0.38) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL19271951 0.89 KDM4E (0.34) ALDH1A1MAPTRAB9ASMN1; SMN2HPGD
SCHEMBL27366726 0.85 GPR3 (0.39) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL15747061 0.85 GPR3 (0.44) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL12206584 0.85 HPRT1 (0.36) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL12206588 0.84 SIGMAR1 (0.35) GPR3CYP1A2ALDH1A1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9601699-B2 Chrysene-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-9601699-B2 Chrysene-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-20150115232-A1 CHRYSENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-30 US disclosed
US-20150115232-A1 CHRYSENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-30 US disclosed