SCHEMBL7978074

SCHEMBL7978074

CN(C)CC1CCN(c2ccc(-c3nc(C(=O)O)c(-c4ccc(Cl)cc4)[nH]3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 5/20 0.40
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KCNH2 Q12809 1/20 0.38
ADORA2A P29274 2/20 0.37
ADORA2B P29275 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
FAAH O00519 1/20 0.37
MELK Q14680 3/20 0.37
NOTUM Q6P988 1/20 0.37
DEGS1 O15121 1/20 0.37
AKR1C3 P42330 1/20 0.36
CHEK2 O96017 1/20 0.36
PRKAB2 O43741 1/20 0.36
PRKAG1 P54619 1/20 0.36
PRKAA2 P54646 1/20 0.36
PRKAA1 Q13131 1/20 0.36
PRKAG3 Q9UGI9 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
SCHEMBL7977693 0.88 PRKD3 (0.46) MAPT
SCHEMBL7991701 0.87 MALT1 (0.41) DGAT1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL7989957 0.86 USP2 (0.48) DGAT1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL7991914 0.83 MEN1 (0.45) DGAT1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL7991843 0.82 AURKA (0.45) DGAT1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL7978071 0.82 CHEK2 (0.39) DGAT1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL7988137 0.81 PRKAB2 (0.52) DGAT1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL7989662 0.81 LMNA (0.45) DGAT1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL7977506 0.81 PRKAB2 (0.43) DGAT1KMT2ASMN1; SMN2PRKAB2PRKAG1
SCHEMBL7991773 0.80 PARP1 (0.51) LMNAMAPTKMT2ASMN1; SMN2AKR1C3

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed