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SCHEMBL16598458

SCHEMBL16598458

CC(C)(c1ccc(N2C(=O)c3ccccc3C2=O)cc1)c1cccc(C(C)(C)c2ccc(N3C(=O)c4cccc(-c5ccc6c(c5)C(=O)N(c5ccc(Oc7cccc(N8C(=O)c9cccc(-c%10ccc%11c(c%10)C(=O)N(c%10ccc(Oc%12cccc(N%13C(=O)c%14ccccc%14C%13=O)c%12)cc%10)C%11=O)c9C8=O)c7)cc5)C6=O)c4C3=O)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.46
▸ KMT2A Q03164 6/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ PKM P14618 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ LPAR1 Q92633 1/20 0.40
▸ LPAR5 Q9H1C0 1/20 0.40
▸ LPAR3 Q9UBY5 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ MCHR1 Q99705 1/20 0.38
▸ GRM5 P41594 1/20 0.37
▸ NR1H2 P55055 1/20 0.37
▸ NR1H3 Q13133 1/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ PTGES O14684 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
SCHEMBL17938180 0.97 BRD4 (0.48) BRD4KMT2AMEN1PKMALDH1A1
SCHEMBL16597893 0.89 BRD4 (0.56) BRD4KMT2AMEN1ALDH1A1POLB
SCHEMBL16598017 0.88 BRD4 (0.58) BRD4KMT2AMEN1ALDH1A1POLB
SCHEMBL21090951 0.82 BRD4 (0.40) BRD4KMT2AMEN1PKMALDH1A1
SCHEMBL22315112 0.81 ALDH1A1 (0.53) BRD4KMT2AMEN1PKMALDH1A1
SCHEMBL9342244 0.80 BRD4 (0.54) BRD4KMT2AMEN1PKMALDH1A1
SCHEMBL24340333 0.79 MAOA (0.55) BRD4KMT2AMEN1PKMALDH1A1
SCHEMBL19706454 0.79 BRD4 (0.38) BRD4KMT2AMEN1PKMALDH1A1
SCHEMBL21123649 0.79 KMT2A (0.62) BRD4KMT2AMEN1PKMALDH1A1
SCHEMBL22627090 0.78 KMT2A (0.56) BRD4KMT2AMEN1PKMALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049459-A1 AROMATIC POLYIMIDES SUITABLE FOR 3D PRINTING PROCESSES PolyOne Corporation (US) 2016-08-03 — — EP claimed
WO-2015048071-A1 AROMATIC POLYIMIDES SUITABLE FOR 3D PRINTING PROCESSES POLYONE CORPORATION (US) 2015-04-02 — — WO claimed
US-20190177484-A1 AROMATIC POLYIMIDES SUITABLE FOR 3D PRINTING PROCESSES POLYONE CORPORATION (US) 2019-06-13 — — US disclosed
US-10240000-B2 Aromatic polyimides suitable for 3D printing processes POLYONE CORPORATION (US) 2019-03-26 — — US disclosed
US-20160215096-A1 PREPARATION OF IMIDE OLIGOMERS VIA CONCURRENT REACTIVE EXTRUSION POLYONE CORPORATION (US) 2016-07-28 — — US disclosed
US-20160215096-A1 PREPARATION OF IMIDE OLIGOMERS VIA CONCURRENT REACTIVE EXTRUSION POLYONE CORPORATION (US) 2016-07-28 — — US disclosed