SCHEMBL27366726

SCHEMBL27366726

c1ccc(-c2ccc(N(c3ccc4sc5ccccc5c4c3)c3cc4c5ccccc5c(N(c5ccc(-c6ccccc6)cc5)c5ccc6sc7ccccc7c6c5)cc4c4ccccc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.39
CYP1A2 P05177 1/20 0.35
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PTPN7 P35236 1/20 0.34
DUSP3 P51452 1/20 0.34
PTPN12 Q05209 1/20 0.34
PTPN22 Q9Y2R2 1/20 0.34
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
PIM3 Q86V86 1/20 0.33
PTGIR P43119 1/20 0.33
LIMK1 P53667 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PTPN1 P18031 1/20 0.31
POLB P06746 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
SCHEMBL12206581 0.93 GPR3 (0.42) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL26056154 0.93 HPRT1 (0.33) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL17126489 0.91 GPR3 (0.36) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL17083564 0.90 GPR3 (0.42) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL14295422 0.90 GPR3 (0.35) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL17126784 0.89 PIM3 (0.35) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL14295425 0.89 GPR3 (0.34) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL23172268 0.88 GPR3 (0.47) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL12414487 0.88 GPR3 (0.47) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL15964354 0.88 GPR3 (0.47) GPR3CYP1A2MAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024035190-A1 ORGANIC LIGHT-EMITTING DIODE AND ORGANIC COMPOUND 솔루스첨단소재 주식회사 2024-02-15 WO disclosed