SCHEMBL19618330

SCHEMBL19618330

c1ccc(-c2ccc3nc(-c4ccccc4)cc(-c4ccc(-c5nc6ccccc6o5)cc4)c3c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 10/20 0.51
▸ RAB9A P51151 9/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ ATM Q13315 1/20 0.51
▸ ALDH1A1 P00352 8/20 0.50
▸ HPGD P15428 8/20 0.50
▸ KDM4E B2RXH2 7/20 0.50
▸ SMN1; SMN2 Q16637 7/20 0.50
▸ HSD17B10 Q99714 4/20 0.50
▸ MAPT P10636 4/20 0.50
▸ CASP3 P42574 3/20 0.50
▸ SENP7 Q9BQF6 3/20 0.50
▸ SENP6 Q9GZR1 3/20 0.50
▸ HCRTR1 O43613 3/20 0.50
▸ USP2 O75604 2/20 0.50
▸ SENP8 Q96LD8 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL19618350 1.00 NPC1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19618470 0.95 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19618319 0.92 ALDH1A1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19618375 0.92 ALDH1A1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19618471 0.90 ALDH1A1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19618293 0.89 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19618354 0.88 HDAC6 (0.47) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19618389 0.88 HDAC6 (0.47) NPC1RAB9AMEN1KMT2AATM
SCHEMBL2952887 0.85 NPC1 (0.52) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13642963 0.85 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM

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
US-9825242-B2 Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode CHEIL INDUSTRIES, INC. (KR) 2017-11-21 — — US disclosed
US-9825242-B2 Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode CHEIL INDUSTRIES, INC. (KR) 2017-11-21 — — US disclosed
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