SCHEMBL7715145

SCHEMBL7715145

CCNC(=O)c1ccc(I)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 7/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
TPMT P51580 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
HDAC4 P56524 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
ALDH1A1 P00352 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
SCHEMBL5909057 0.89 CA12 (0.58) CA12CA9MEN1LMNAMAPT
Chlorobenzene SCHEMBL28001559 0.87 LMNA (0.52) FOLH1MEN1LMNAMAPTHPGD
SCHEMBL17553165 0.84 KDM4E (0.60) FOLH1CYP1A2CYP2D6CYP2C9KMT2A
SCHEMBL9475078 0.83 CYP1A2 (0.51) FOLH1CYP1A2CYP2D6CYP2C9LMNA
SCHEMBL13382304 0.82 HPGDS (0.48) MEN1KMT2AHDAC4HDAC6ALDH1A1
SCHEMBL18782285 0.81 L3MBTL1 (0.63) FOLH1CA2ALDH1A1
SCHEMBL12347956 0.81 EPHX2 (0.54) CA12CA9MEN1LMNAMAPT
SCHEMBL8158111 0.81 NR1H4 (0.54) CA12CA9CYP1A2MEN1LMNA
SCHEMBL13702393 0.81 PLK1 (0.66) CA12CA9MEN1LMNAMAPT
SCHEMBL92285 0.81 GFER (0.59) CA12CA9CYP1A2CYP2D6MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170233726-A1 Method for Making an Enriched Library VIPERGEN APS (DK) 2017-08-17 US disclosed
WO-2016138135-A1 SIGMA-1 RECEPTOR MODULATORS FOR TREATING HUNTINGTON'S DISEASE TEVA PHARMACEUTICALS INTERNATIONAL GMBH (CH) 2016-09-01 WO disclosed
CN-105408332-A Substituted triazolopyridines Bayer Pharma AG 2016-03-16 CN disclosed
US-20130288929-A1 Method for Making an Enriched Library VIPERGEN (DK) 2013-10-31 US disclosed
WO-2011088405-A1 PLASMA MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES, INCORPORATED (US) 2011-07-21 WO disclosed
EP-2073850-B1 HYBRID BLOCK COPOLYMER MICELLES WITH MIXED STEREOCHEMISTRY FOR ENCAPSULATION OF HYDROPHOBIC AGENTS INTEZYNE TECHNOLOGIES INC (US) 2010-10-27 EP disclosed
US-20100098633-A1 SELECTIVE SEPRASE INHIBITORS MOLECULAR INSIGHT PHARMACEUTICALS, INC. 2010-04-22 US disclosed
EP-1907444-B1 POLYMERIC MICELLES FOR DRUG DELIVERY INTEZYNE TECHNOLOGIES INC (US) 2009-08-19 EP disclosed
WO-2008134734-A2 ENCAPSULATED CONTRAST AGENTS INTEZYNE TECHNOLOGIES, INC. (US) 2008-11-06 WO disclosed
WO-2008106657-A2 ENCAPSULATED AMYLOID-BETA PEPTIDES INTEZYNE TECHNOLOGIES, INC. (US) 2008-09-04 WO disclosed
US-6368608-B1 SKIN DISORDERS CENTRE INTERNATIONAL DE RECHERCHE DERMATOLOGIQUES GALDERMA (C.I.R.D.) (FR) 2002-04-09 US disclosed
US-6162445-A Polyaromatic propynyl compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-12-19 US disclosed
EP-0661258-B1 Biaromatic propynyl compounds, pharmaceutical compositions and cosmetics containing them and their uses CIRD GALDERMA (FR) 1998-04-08 EP disclosed
US-5716624-A USEFUL FOR TREATING DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, OPTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS/DISORDERS C.I.R.D. GALDERMA (FR) 1998-02-10 US disclosed
EP-0661258-A1 Biaromatic propynyl compounds, pharmaceutical compositions and cosmetics containing them and their uses CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-07-05 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-20100098633-A1 SELECTIVE SEPRASE INHIBITORS SLC6A7, DNPEP, PREP FOLH1 41/4885CA12 2126/4885CA9 2404/4885

“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.