SCHEMBL18327808

SCHEMBL18327808

Cc1ccc(-c2nc(-c3ccc(C)cc3)nc(-n3c4ccc(C(C)(C)C)cc4c4c5cc(C(C)(C)C)ccc5n(-c5ccc(C)cc5)c43)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ RAB9A P51151 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ TP53 P04637 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ PTK2 Q05397 1/20 0.32
▸ CYP19A1 P11511 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ SIRT2 Q8IXJ6 1/20 0.31
▸ SIRT1 Q96EB6 1/20 0.31
▸ MEN1 O00255 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
SCHEMBL11976578 0.87 RAB9A (0.41) ALDH1A1MAPTNPSR1RAB9ANPC1
SCHEMBL18327839 0.84 ABCG2 (0.39) ALDH1A1MAPTMAPK1NPSR1RAB9A
SCHEMBL12132304 0.80 RAB9A (0.35) ALDH1A1MAPTRAB9ANPC1TP53
SCHEMBL22065079 0.79 ABCG2 (0.45) ALDH1A1MAPTMAPK1NPSR1RAB9A
SCHEMBL18327821 0.79 ALDH1A1 (0.41) ALDH1A1MAPTNPSR1RAB9ANPC1
SCHEMBL10363562 0.78 ALDH1A1 (0.39) ALDH1A1MAPTMAPK1NPSR1RAB9A
SCHEMBL29365018 0.78 ABCG2 (0.44) ALDH1A1MAPTMAPK1NPSR1RAB9A
SCHEMBL28679875 0.78 ABCG2 (0.44) ALDH1A1MAPTMAPK1NPSR1RAB9A
SCHEMBL10316919 0.78 KDM4E (0.42) ALDH1A1MAPTMAPK1NPSR1RAB9A
SCHEMBL12132303 0.77 RAB9A (0.34) ALDH1A1MAPTRAB9ANPC1TP53

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-20160372683-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, ILLUMINATION DEVICE, AND LIGHT-EMITTING COMPOSITION Konica Minolta, Inc. (JP) 2016-12-22 — — US disclosed
US-20160372683-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, ILLUMINATION DEVICE, AND LIGHT-EMITTING COMPOSITION Konica Minolta, Inc. (JP) 2016-12-22 — — US disclosed
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