SCHEMBL10875619

SCHEMBL10875619

CCCCc1ccc(Nc2ccc(N)c3c2C(=O)C(C#N)=C(C#N)C3=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ MAPT P10636 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ CA2 P00918 4/20 0.37
▸ CA12 O43570 3/20 0.37
▸ CA1 P00915 3/20 0.37

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
SCHEMBL10876607 0.81 GAA (0.43) HPGDSMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL1476038 0.81 HPGD (0.50) HPGDNPSR1SMN1; SMN2NPC1RAB9A
SCHEMBL10875079 0.80 EGFR (0.44) HPGDNPSR1SMN1; SMN2NPC1RAB9A
SCHEMBL5870790 0.80 CTDSP1 (0.46) HPGDNPSR1NPC1RAB9AL3MBTL1
SCHEMBL1476804 0.79 HPGD (0.44) HPGDNPSR1SMN1; SMN2NPC1RAB9A
SCHEMBL4956416 0.79 GAA (0.50) HPGDSMN1; SMN2L3MBTL1ALDH1A1MAPT
SCHEMBL8080141 0.78 ALDH3A1 (0.37) HPGDNPSR1SMN1; SMN2NPC1RAB9A
SCHEMBL10877705 0.78 DHODH (0.37) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL10874373 0.78 MAPT (0.46) HPGDNPSR1SMN1; SMN2NPC1RAB9A
SCHEMBL29699621 0.77 UNG (0.51) HPGDNPSR1NPC1RAB9AL3MBTL1

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
JP-58224793-A — — None — — JP disclosed
JP-59073996-A — — None — — JP disclosed
EP-0097929-B1 OPTICAL INFORMATION RECORDING MEDIUM FOR SEMICONDUCTOR LASER NEC CORPORATION (JP) 1986-10-01 — — EP disclosed
US-4504548-A Optical information recording medium for semiconductor laser NEC CORPORATION (JP) 1985-03-12 — — US disclosed
JP-S5973996-A OPTICAL RECORDING MEDIUM NEC CORP 1984-04-26 — — JP disclosed
EP-0097929-A1 Optical information recording medium for semiconductor laser NEC CORPORATION (JP) 1984-01-11 — — EP disclosed
JP-S58224793-A OPTICAL RECORDING MEDIUM NEC CORP 1983-12-27 — — JP disclosed
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