SCHEMBL5852186

SCHEMBL5852186

Cc1ccc(NC(=O)Nc2ccccc2C)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDX3X O00571 3/20 0.70
RAB9A P51151 9/20 0.69
NPC1 O15118 7/20 0.69
MAPT P10636 3/20 0.69
KMT2A Q03164 2/20 0.69
MEN1 O00255 1/20 0.69
HTT P42858 1/20 0.69
SMN1; SMN2 Q16637 2/20 0.66
L3MBTL1 Q9Y468 2/20 0.58
KDM4E B2RXH2 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
STING1 Q86WV6 1/20 0.57
POLB P06746 1/20 0.57
ALDH1A1 P00352 2/20 0.56
HPGD P15428 1/20 0.56
IMPDH2 P12268 1/20 0.56
TP53 P04637 1/20 0.55

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
SCHEMBL812756 0.89 DDX3X (0.80) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL1275926 0.87 RAB9A (0.75) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL3460449 0.86 DDX3X (0.70) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL17079606 0.86 RAB9A (0.66) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL17084259 0.86 RAB9A (0.67) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL687547 0.86 RAB9A (0.66) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL13070081 0.86 RAB9A (0.75) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL6799221 0.85 RAB9A (0.73) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL27568751 0.84 DDX3X (0.73) DDX3XRAB9ANPC1MAPTKMT2A
SCHEMBL17079620 0.83 RAB9A (0.68) DDX3XRAB9ANPC1MAPTKMT2A

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6630512-B2 Antiinflammatory agents; autoimmune disease BIOGEN, INC. 2003-10-07 US claimed
US-6624152-B2 Inhibition and prevention of cell adhesion and cell adhesion-mediated pathologies. This invention relates to pharmaceutical formulations comprising these compounds and methods of using them for inflammatory and autoimmune diseases BIOGEN, INC. 2003-09-23 US claimed
US-20030083267-A1 Cell adhesion inhibitors BIOGEN, INC., A MASSACHUSETTS CORPORATION 2003-05-01 US claimed
US-20030018016-A1 Cell adhesion inhibitors BIOGEN IDEC MA, INC. 2003-01-23 US claimed
EP-0805796-B1 CELL ADHESION INHIBITORS BIOGEN INC (US) 2002-12-11 EP claimed
US-6376538-B1 ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASES BIOGEN, INC. 2002-04-23 US claimed
US-6306840-B1 ANTISTICKING AGENTS OF OLIGOPEPTIDES BIOGEN, INC. 2001-10-23 US claimed
EP-0805796-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1997-11-12 EP claimed
WO-1996022966-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1996-08-01 WO claimed
US-9884812-B2 Use of DDX3X inhibitors for the treatment of pneumovirus infections UNIVERSITY OF WARWICK (GB) 2018-02-06 US disclosed
US-20170166519-A1 USE OF DDX3X INHIBITORS FOR THE TREATMENT OF PNEUMOVIRUS INFECTIONS UNIVERSITY OF WARWICK (GB) 2017-06-15 US disclosed
US-9321766-B1 Kinase inhibitors ALLERGAN, INC. (US) 2016-04-26 US disclosed
US-20160096832-A1 KINASE INHIBITORS ALLERGAN, INC. 2016-04-07 US disclosed
WO-2015136292-A1 USE OF DDX3X INHIBITORS FOR THE TREATMENT OF PNEUMOVIRUS INFECTIONS UNIVERSITY OF WARWICK (GB) 2015-09-17 WO disclosed
EP-1142867-A2 Cell adhesion inhibitors BIOGEN, INC. (US) 2001-10-10 EP disclosed
WO-2001051487-A1 NON-PEPTIDYL INHIBITORS OF VLA-4 DEPENDENT CELL BINDING USEFUL IN TREATING INFLAMMATORY, AUTOIMMUNE, AND RESPIRATORY DISEASES PFIZER PRODUCTS INC. (US) 2001-07-19 WO disclosed
EP-1091943-A1 NON-PEPTIDYL INHIBITORS OF VLA-4 DEPENDENT CELL BINDING USEFUL IN TREATING INFLAMMATORY, AUTOIMMUNE, AND RESPIRATORY DISEASES Pfizer Products Inc. (US) 2001-04-18 EP disclosed
WO-2000000477-A1 NON-PEPTIDYL INHIBITORS OF VLA-4 DEPENDENT CELL BINDING USEFUL IN TREATING INFLAMMATORY, AUTOIMMUNE, AND RESPIRATORY DISEASES PFIZER PRODUCTS INC. (US) 2000-01-06 WO disclosed
EP-0805796-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1997-11-12 EP disclosed
WO-1996022966-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1996-08-01 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 (4 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-20030083267-A1 Cell adhesion inhibitors ICAM1, VCAM1, EPCAM DDX3X 3590/4885RAB9A 1779/4885NPC1 2649/4885
US-20160096832-A1 KINASE INHIBITORS ABL1, LCK, ERBB2 DDX3X 2023/4885RAB9A 2799/4885NPC1 4204/4885
US-20030018016-A1 Cell adhesion inhibitors ICAM1, VCAM1, EPCAM DDX3X 3590/4885RAB9A 1779/4885NPC1 2649/4885
US-20170166519-A1 USE OF DDX3X INHIBITORS FOR THE TREATMENT OF PNEUMOVIRUS INFECTIONS DDX3X, DDX1, DDX5 DDX3X 1/4885RAB9A 873/4885NPC1 2429/4885

“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.