SCHEMBL16167617

SCHEMBL16167617

c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)-c3ccccc3-c3ccccc3-c3cc(-c5nc6ccccc6o5)ccc3-4)c3ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.49
▸ ALDH1A1 P00352 8/20 0.49
▸ KDM4E B2RXH2 7/20 0.49
▸ HPGD P15428 7/20 0.49
▸ MAPT P10636 3/20 0.49
▸ USP2 O75604 2/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ NPC1 O15118 8/20 0.48
▸ RAB9A P51151 6/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ ATM Q13315 1/20 0.48
▸ SMN1; SMN2 Q16637 6/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ HCRTR1 O43613 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47

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
SCHEMBL16167614 0.95 ALDH1A1 (0.49) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL16167619 0.95 NPC1 (0.54) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL16167613 0.92 NPC1 (0.49) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL13620961 0.88 NPC1 (0.51) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL13620960 0.88 KDM4E (0.51) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL22955745 0.86 KDM4E (0.50) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL13872550 0.86 NPC1 (0.54) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL1925604 0.86 NPC1 (0.63) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL13620979 0.86 TP53 (0.44) TP53ALDH1A1KDM4EHPGDMAPT
SCHEMBL21250826 0.85 TP53 (0.53) TP53ALDH1A1KDM4EHPGDMAPT

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
US-8859108-B2 Benzoxazole derivative, and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-14 — — US disclosed
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