SCHEMBL3790049

SCHEMBL3790049

O=C(Nc1ccc(Cl)c(NC(=O)c2ccccc2)c1)c1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.83
RAB9A P51151 4/20 0.76
NPC1 O15118 3/20 0.76
HDAC1 Q13547 2/20 0.68
HDAC8 Q9BY41 2/20 0.68
HDAC6 Q9UBN7 2/20 0.68
GRM4 Q14833 1/20 0.62
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
KCNK3 O14649 3/20 0.61
KCNK9 Q9NPC2 3/20 0.61
TP53 P04637 1/20 0.60
SMO Q99835 2/20 0.59
ALDH1A1 P00352 2/20 0.59
KDM4E B2RXH2 1/20 0.59
LMNA P02545 1/20 0.59
POLB P06746 1/20 0.59

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
SCHEMBL10238371 0.91 MAPT (1.00) MAPTRAB9ANPC1HDAC1HDAC8
SCHEMBL10238305 0.88 KCNK9 (0.69) MAPTRAB9ANPC1HDAC1HDAC8
SCHEMBL3783679 0.87 GRM4 (0.79) MAPTRAB9ANPC1GRM4MEN1
SCHEMBL10238385 0.87 MEN1 (0.70) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL403184 0.87 KCNQ3 (0.67) MAPTRAB9ANPC1HDAC1HDAC8
SCHEMBL10238306 0.87 MAPT (0.65) MAPTRAB9ANPC1HDAC1HDAC8
SCHEMBL30369807 0.86 NPC1 (1.00) MAPTRAB9ANPC1GRM4MEN1
SCHEMBL4254257 0.86 NPC1 (1.00) MAPTRAB9ANPC1GRM4MEN1
SCHEMBL8819672 0.85 MEN1 (0.82) MAPTRAB9ANPC1HDAC1HDAC8
SCHEMBL6676301 0.84 MAPK14 (0.77) MAPTRAB9ANPC1HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1359371-A Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRA ZENECA LTD (SE) 2002-07-17 CN claimed
EP-1077930-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP claimed
WO-1999059960-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 1999-11-25 WO claimed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP disclosed
CN-1188389-C Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRA ZENECA LTD (SE) 2005-02-09 CN disclosed
EP-1077930-B1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 2004-11-10 EP disclosed
US-6465455-B1 TUMOUR NECROSIS FACTOR AND INTERLEUKIN FAMILY INHIBITORS; INHIBITION OF ENZYME P38 KINASE; INFLAMMATION, IMMUNO-REGULATION, ALLERGIES ASTRAZENECA AB (SE) 2002-10-15 US disclosed
CN-1359371-A Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRA ZENECA LTD (SE) 2002-07-17 CN disclosed
EP-1077930-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP disclosed
WO-1999059960-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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 MAPT 3312/4885RAB9A 1357/4885NPC1 724/4885

“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.