SCHEMBL2170788

SCHEMBL2170788

O=[C]C(c1ccccc1)C1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
LMNA P02545 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HTR1E P28566 2/20 0.44
S1PR3 Q99500 2/20 0.44
MAPT P10636 1/20 0.44
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CHRM3 P20309 3/20 0.41
EPHX1 P07099 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL3071813 0.98 IDO1 (0.49) IDO1LMNAMEN1KMT2AHTR1E
SCHEMBL7115970 0.92 IDO1 (0.44) IDO1LMNAMEN1KMT2AHTR1E
SCHEMBL961019 0.80 SLC6A3 (0.57) IDO1LMNAMEN1KMT2AHTR1E
SCHEMBL8910008 0.79 CYP19A1 (0.42) MAPTGAAL3MBTL1EPHX1KDM4E
SCHEMBL13124077 0.78 SLC6A3 (0.58) IDO1LMNAMEN1KMT2AHTR1E
SCHEMBL959762 0.78 SLC6A3 (0.58) IDO1LMNAMEN1KMT2AHTR1E
SCHEMBL8909681 0.78 CYP11B2 (0.44) MAPTKDM4ECYP3A4CYP2C19
SCHEMBL961750 0.76 SLC6A3 (0.53) IDO1LMNAMEN1KMT2AHTR1E
SCHEMBL28135586 0.73 IDO1 (0.47) IDO1LMNAMEN1KMT2AHTR1E
SCHEMBL522585 0.72 IDO1 (0.50) IDO1LMNAMEN1KMT2AHTR1E

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-20110319592-A1 Process for the Purification of Antibodies Using Affinity Resins Comprising Specific Ligands NOVO NORDISK A/S (DK) 2011-12-29 US disclosed
EP-2346892-A1 PROCESS FOR THE PURIFICATION OF ANTIBODIES USING AFFINITY RESINS COMPRISING SPECIFIC LIGANDS Novo Nordisk A/S (DK) 2011-07-27 EP disclosed
WO-2010055136-A1 PROCESS FOR THE PURIFICATION OF ANTIBODIES USING AFFINITY RESINS COMPRISING SPECIFIC LIGANDS NOVO NORDISK A/S (DK) 2010-05-20 WO disclosed
US-7071168-B2 Anti-cancer compounds and methods related thereto THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2006-07-04 US disclosed
CN-1370526-A Treating method of nuclear factor-KB mediated diseases and dysfuction WANER LONGBER CO (US) 2002-09-25 CN disclosed
US-6388054-B1 AMINO ACID SEQUENCES OF ANTITUMOR AGENTS AND APOPTOSIS AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-05-14 US disclosed
WO-2000011022-A1 ANTI-CANCER COMPOUNDS AND METHODS RELATED THERETO STEWART JOHN M (US) 2000-03-02 WO disclosed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP 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-20110319592-A1 Process for the Purification of Antibodies Using Affinity Resins Comprising Specific Ligands FCGR1A, FCGR2A, FCGR3B IDO1 3886/4885LMNA 4496/4885MEN1 3637/4885

“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.