SCHEMBL21037615

SCHEMBL21037615

CC1(C)c2ccccc2C2(c3ccccc3-c3cc(N(c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4ccc5sc6ccccc6c5c4)ccc32)c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.32
▸ PTPN7 P35236 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ PTPN12 Q05209 1/20 0.32
▸ PTPN22 Q9Y2R2 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ CYP1A2 P05177 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
SCHEMBL24647507 1.00 GPR3 (0.32) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL14681291 0.94 GPR3 (0.34) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL25563647 0.94 GPR3 (0.36) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL21558961 0.93 PDK2 (0.34) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL21037585 0.93 PDK2 (0.34) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL19801889 0.92 GPR3 (0.33) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL24904782 0.92 F9 (0.30) —
SCHEMBL21559034 0.91 PIM3 (0.33) —
SCHEMBL25145508 0.91 GPR3 (0.32) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL16544680 0.91 GPR3 (0.32) GPR3ALDH1A1MAPTHPGDRAB9A

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-2019103397-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2019-05-31 — — WO disclosed
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