SCHEMBL14828575

SCHEMBL14828575

COc1cc(N2C(=O)c3ccc4c5c(Br)cc6c7c(ccc(c8c(Br)cc(c3c48)C2=O)c75)C(=O)N(c2cc(OC)c(OC)c(OC)c2)C6=O)cc(OC)c1OC

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.40
▸ POLB P06746 2/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPK1 P28482 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PABPC1 P11940 1/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMARCA2 P51531 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36

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
SCHEMBL14827378 0.89 KMT2A (0.36) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL15078808 0.85 ALOX5 (0.36) —
SCHEMBL8188990 0.80 KMT2A (0.42) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL15077485 0.80 ALOX5 (0.35) —
SCHEMBL14827377 0.79 KMT2A (0.38) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL14706337 0.78 THRA (0.35) ALDH1A1KDM4ELMNAMAPT
SCHEMBL14706558 0.76 POLB (0.44) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL23618188 0.75 TERT (0.35) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL27403934 0.75 KMT2A (0.47) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL14827382 0.74 MAPT (0.35) ALDH1A1KMT2AMEN1KDM4ELMNA

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-20130085249-A1 CONJUGATED POLYMER BASED ON PERYLENE TETRACARBOXYLIC ACID DIIMIDE AND DIBENZOTHIOPHENE AND THE PREPARATION METHOD AND APPLICATION THEREOF OCEAN'S KING LIGHTING SCIENCE &TECHNOLOGY CO., LTD (CN) 2013-04-04 — — US disclosed
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