SCHEMBL7478332

SCHEMBL7478332

CC(=O)c1ccc(C(=O)N(CC(=O)N(Cc2ccccc2)[C@@H](C)c2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ LMNA P02545 2/20 0.46
▸ OPRD1 P41143 1/20 0.44
▸ CTSS P25774 3/20 0.43
▸ CTSL P07711 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ HDAC3 O15379 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ TRPM8 Q7Z2W7 2/20 0.40
▸ CTSK P43235 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HPGD P15428 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
SCHEMBL7478329 1.00 KMT2A (0.46) KMT2AMEN1LMNAOPRD1CTSS
SCHEMBL7473110 0.79 LTA4H (0.46) KMT2AMEN1LMNACTSSCTSL
SCHEMBL7473115 0.79 LTA4H (0.46) KMT2AMEN1LMNACTSSCTSL
SCHEMBL15111088 0.79 TRPM8 (0.56) KMT2AMEN1TRPM8L3MBTL1
SCHEMBL18711381 0.75 MEN1 (0.56) KMT2AMEN1LMNAALDH1A1L3MBTL1
SCHEMBL18711384 0.75 MEN1 (0.56) KMT2AMEN1LMNAALDH1A1L3MBTL1
SCHEMBL18711382 0.71 MEN1 (0.54) KMT2AMEN1LMNAALDH1A1TRPM8
SCHEMBL7463206 0.71 KMT2A (0.55) KMT2AMEN1LMNAALDH1A1L3MBTL1
SCHEMBL7463209 0.71 KMT2A (0.55) KMT2AMEN1LMNAALDH1A1L3MBTL1
SCHEMBL8012604 0.71 ALDH1A1 (0.59) CTSSCTSLALDH1A1HDAC3HDAC1

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-0871619-B1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMA (US) 2002-11-06 — — EP disclosed
US-6458959-B1 VIRICIDES AND ENZYME INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2002-10-01 — — US disclosed
US-6348477-B1 SUBSTITUTED PHENYL THIAZOLE DERIVATIVES AS VIRICIDES BOEHRINGER INGELHEIM(CANADA) LTD. (CA) 2002-02-19 — — US disclosed
US-6057451-A AMINOTHIAZOLE DERIVATIVES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-05-02 — — US disclosed
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