SCHEMBL5897192

SCHEMBL5897192

Cc1ccc(NC(=O)c2ccc(C#N)cc2)cc1NC(=O)c1ccc(Cl)nc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KCNQ3 O43525 7/20 0.56
KCNQ2 O43526 7/20 0.56
KCNE1 P15382 5/20 0.53
KCNQ1 P51787 5/20 0.53
MAPT P10636 2/20 0.50
MAPK14 Q16539 2/20 0.50
TDP1 Q9NUW8 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
NPC1 O15118 1/20 0.48
BACE1 P56817 1/20 0.48

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
SCHEMBL5897126 0.86 MAPK14 (0.52) MEN1KMT2AL3MBTL1RAB9AKCNQ3
SCHEMBL6477268 0.83 MAPK14 (0.61) MEN1KMT2ARAB9AMAPTMAPK14
SCHEMBL6484987 0.81 NPC1 (0.51) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL5215873 0.80 BRAF (0.63) CYP2C9
SCHEMBL2303285 0.80 KCNQ3 (0.80) MEN1KMT2ARAB9ASMN1; SMN2KCNQ3
SCHEMBL2306227 0.79 RAB9A (0.67) MEN1KMT2AL3MBTL1RAB9ASMN1; SMN2
SCHEMBL404209 0.78 SMN1; SMN2 (0.74) MEN1KMT2ARAB9ASMN1; SMN2KCNQ3
SCHEMBL6485161 0.78 MAPK14 (0.67) MEN1KMT2ARAB9AMAPTMAPK14
SCHEMBL5897160 0.78 MAPK14 (0.70) MEN1KMT2ARAB9ASMN1; SMN2KCNQ3
SCHEMBL18109908 0.78 HSF1 (0.67) MEN1KMT2ARAB9ASMN1; SMN2KCNQ3

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
US-7060700-B2 Amide derivatives useful as inhibitors of the production of cytokines ASTRAZENECA AB (SE) 2006-06-13 US disclosed
US-6432949-B1 Amide derivatives useful as inhibitors of the production of cytokines ASTRAZENECA AB (SE) 2002-08-13 US disclosed
EP-1102750-A1 AMIDE DERIVATIVES USEFUL AS INHIBITORS OF THE PRODUCTION OF CYTOKINES AstraZeneca AB (SE) 2001-05-30 EP disclosed
WO-2000007991-A1 AMIDE DERIVATIVES USEFUL AS INHIBITORS OF THE PRODUCTION OF CYTOKINES ASTRAZENECA AB (SE) 2000-02-17 WO disclosed