SCHEMBL4865360

SCHEMBL4865360

c1ccc(Oc2ccc(-c3ccc(-c4ccnc5c4ccc4c(-c6ccc(-c7ccc(Oc8ccccc8)cc7)cc6)ccnc45)cc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.49
GSTP1 P09211 1/20 0.47
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALK Q9UM73 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SCN4A P35499 1/20 0.42
PIK3CA P42336 1/20 0.42
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NISCH Q9Y2I1 1/20 0.41
MAPT P10636 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40

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
SCHEMBL28083090 0.86 LTA4H (0.54) LTA4HGSTP1ALDH1A1MEN1KMT2A
SCHEMBL3289250 0.86 PIK3CA (0.53) L3MBTL1ALKPIK3CATOP2AIKBKB
SCHEMBL10032425 0.84 IKBKB (0.52) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL6557994 0.82 MAPT (0.52) ALDH1A1MEN1KMT2AL3MBTL1NPC1
Benzene SCHEMBL28095234 0.82 IKBKB (0.53) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL28859500 0.82 IKBKB (0.53) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL28868 0.82 IKBKB (0.53) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL4862216 0.81 GSTP1 (0.55) LTA4HGSTP1MEN1KMT2ACYP1A2
SCHEMBL5341478 0.80 IKBKB (0.52) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
Ammonia Solution, Strong SCHEMBL17396339 0.80 IKBKB (0.52) ALDH1A1MEN1KMT2ACYP1A2CYP2C9

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-7416791-B1 Osmium complexes and related organic light-emitting devices UNIVERSITY OF WASHINGTON (US) 2008-08-26 US claimed
US-7416791-B1 Osmium complexes and related organic light-emitting devices UNIVERSITY OF WASHINGTON (US) 2008-08-26 US disclosed