SCHEMBL6484470

SCHEMBL6484470

CCN(CC)Cc1ccc(C(=O)Nc2cc(NC(=O)c3cc(N4CCOCC4)ccc3[N+](=O)[O-])ccc2C)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.50
MAPT P10636 7/20 0.49
NPC1 O15118 2/20 0.48
ALDH1A1 P00352 5/20 0.46
POLB P06746 1/20 0.46
SMO Q99835 1/20 0.46
MAPK1 P28482 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 1/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL27558565 0.84 MAPK1 (0.57) MAPK14MAPTNPC1ALDH1A1SMO
SCHEMBL6482784 0.84 MAPK14 (0.48) MAPK14MAPTNPC1ALDH1A1POLB
SCHEMBL6487809 0.84 MAPK14 (0.69) MAPK14MAPTSMOHTTSMN1; SMN2
SCHEMBL6477337 0.83 F10 (0.53) MAPTNPC1ALDH1A1POLBMAPK1
SCHEMBL2972175 0.81 MAPK14 (0.60) MAPK14SMO
SCHEMBL6477438 0.81 MAPK14 (0.67) MAPK14SMO
SCHEMBL6977502 0.81 MAPK14 (0.56) MAPK14NPC1SMOMAPK1TP53
SCHEMBL7809453 0.81 MAPK14 (0.57) MAPK14NPC1SMOMAPK1MEN1
SCHEMBL6476914 0.79 MAPK14 (0.50) MAPK14MAPTNPC1ALDH1A1POLB
SCHEMBL7809428 0.79 ALDH1A1 (0.50) MAPK14MAPTALDH1A1POLBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6956037-B2 Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRAZENECA AB (SE) 2005-10-18 US disclosed
EP-1077931-B1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 2004-11-17 EP disclosed
US-20030212068-A1 Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRAZENECA AB 2003-11-13 US disclosed
US-6579872-B1 Such as TNF, in particular of TNF alpha, and various interleukins, in particular IL-1; N-(5-(4-(3-hydroxypropoxy)benzamido)-2-methylphenyl)-3,4-dimethoxybenzamide ASTRAZENECA AB (SE) 2003-06-17 US disclosed
EP-1077931-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP disclosed
WO-1999059959-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 1999-11-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030212068-A1 Benzamide derivatives for the treatment of diseases mediated by cytokines IL2, IL6, IL6ST MAPK14 2054/4885MAPT 4386/4885NPC1 1549/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.