SCHEMBL6487799

SCHEMBL6487799

CCN(CC)Cc1ccc(C(=O)Nc2cc(N)ccc2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.55
HDAC6 Q9UBN7 3/20 0.55
BCHE P06276 1/20 0.51
ACHE P22303 2/20 0.50
CYP2C19 P33261 2/20 0.48
MAPT P10636 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
F10 P00742 1/20 0.47
HDAC1 Q13547 6/20 0.46
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
SLC22A2 O15244 1/20 0.45
SLC22A1 O15245 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
LDLR P01130 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
HDAC3 O15379 3/20 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
SCHEMBL6487730 0.81 HTT (0.68) HDAC8HDAC6MAPTLMNAALDH1A1
SCHEMBL14810361 0.80 CYP1A2 (0.60) HDAC8HDAC6CYP2C19MAPTCYP1A2
SCHEMBL14809773 0.80 MAPT (0.60) HDAC8HDAC6CYP2C19MAPTCYP1A2
SCHEMBL6477653 0.79 BCHE (0.53) HDAC8HDAC6BCHEACHEMAPT
SCHEMBL6484244 0.78 NPC1 (0.50) HDAC8HDAC6BCHEACHEMAPT
SCHEMBL5789916 0.78 MAPT (0.57) HDAC8HDAC6CYP2C19MAPTCYP1A2
SCHEMBL29960273 0.78 MAPT (0.57) HDAC8HDAC6CYP2C19MAPTCYP1A2
SCHEMBL31114256 0.78 CYP1A2 (0.60) HDAC8HDAC6CYP2C19MAPTCYP1A2
SCHEMBL7673456 0.78 ABL1 (0.51) HDAC8HDAC6BCHEACHEMAPT
SCHEMBL31173053 0.78 MAPT (0.54) HDAC8HDAC6CYP2C19MAPTCYP1A2

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 10 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
EP-1115707-B1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2003-11-12 EP 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
US-6455520-B1 TUMOR NECROSIS FACTOR AND INTERLEUKIN INHIBITORS; ANTIINFLAMMATORY AGENTS, ANTIALLERGENS; BONE DISORDERS ASTRA ZENECA AB (SE) 2002-09-24 US disclosed
EP-1115707-A1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS AstraZeneca AB (SE) 2001-07-18 EP disclosed
EP-1077931-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP disclosed
WO-2000018738-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2000-04-06 WO 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 HDAC8 374/4885HDAC6 98/4885BCHE 1232/4885

“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.