SCHEMBL19986214

SCHEMBL19986214

Cc1csc(NC(=O)CNC(=O)OCC2c3ccccc3-c3ccccc32)c1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ EPHX2 P34913 1/20 0.39
▸ MAPT P10636 5/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CRHBP P24387 1/20 0.36
▸ CRHR2 Q13324 1/20 0.36
▸ OPRD1 P41143 1/20 0.35
▸ CXCR2 P25025 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ FABP7 O15540 1/20 0.34
▸ FABP5 Q01469 1/20 0.34

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
SCHEMBL29424172 0.86 CASP3 (0.39) KMT2AEPHX2MAPTALDH1A1LMNA
SCHEMBL20819232 0.83 CASP3 (0.44) KMT2AMAPTTP53
SCHEMBL20819231 0.83 CASP3 (0.44) KMT2AMAPTTP53
SCHEMBL29424162 0.78 MDM2 (0.38) MAPTALDH1A1TP53
SCHEMBL27906755 0.76 KMT2A (0.52) KMT2AEPHX2MAPTALDH1A1LMNA
SCHEMBL26327177 0.75 EPHX2 (0.49) KMT2AEPHX2FABP5
SCHEMBL12152373 0.74 ALDH1A1 (0.46) KMT2AEPHX2MAPTKDM4ENPSR1
SCHEMBL1252591 0.74 KMT2A (0.47) KMT2AEPHX2MAPTNPSR1LMNA
SCHEMBL14864719 0.74 KMT2A (0.47) KMT2AEPHX2MAPTNPSR1LMNA
SCHEMBL19931689 0.74 EPHX2 (0.51) KMT2AEPHX2MAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512853-B1 FUSED 1,4-DIAZEPINES AS BET PROTEIN DEGRADERS UNIV MICHIGAN REGENTS (US) 2020-12-23 — — EP disclosed
WO-2019055444-A1 BET BROMODOMAIN PROTEIN DEGRADERS WITH CLEAVABLE LINKERS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-03-21 — — WO disclosed
WO-2018144789-A1 FUSED 1,4-DIAZEPINES AS BET BROMODOMAIN INHIBITORS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2018-08-09 — — WO disclosed
WO-2018052949-A1 FUSED 1,4-DIAZEPINES AS BET PROTEIN DEGRADERS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2018-03-22 — — WO disclosed
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