SCHEMBL27619917

SCHEMBL27619917

COCC(CNC(=O)C(=O)Nc1ccc(Cl)cn1)NC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ RAB9A P51151 9/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ L3MBTL1 Q9Y468 4/20 0.44
▸ LMNA P02545 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NFKB1 P19838 2/20 0.43
▸ NFKB2 Q00653 2/20 0.43
▸ RELA Q04206 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42

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
SCHEMBL5543008 1.00 PTK2 (0.45) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL6421351 0.88 PTK2 (0.46) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL14496990 0.86 SYK (0.51) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL5542886 0.85 L3MBTL1 (0.44) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL5544848 0.84 PTK2 (0.45) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL5543092 0.83 SMN1; SMN2 (0.44) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL5549087 0.82 RAB9A (0.51) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL5548909 0.82 RAB9A (0.51) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL5548889 0.82 PTK2 (0.45) PTK2TDP1RAB9ANPC1L3MBTL1
SCHEMBL5548531 0.81 L3MBTL1 (0.48) PTK2TDP1RAB9ANPC1L3MBTL1

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
CN-1745071-A Novel ethylenediamine derivative DAIICHI SEIYAKU CO (JP) 2006-03-08 — — CN disclosed
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