SCHEMBL1600227

SCHEMBL1600227

Cc1cc(Cl)c(Nc2ccccn2)cc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPK10 P53779 3/20 0.50
GFER P55789 1/20 0.50
CCNK O75909 1/20 0.46
CCNA2 P20248 1/20 0.46
CDK2 P24941 1/20 0.46
CCND3 P30281 1/20 0.46
CDK9 P50750 1/20 0.46
CDK6 Q00534 1/20 0.46
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 3/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP2 O95551 2/20 0.41
CASP6 P55212 2/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41

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
SCHEMBL13421548 0.83 CDK2 (0.42) MEN1KMT2AMAPK10GFERCCNK
SCHEMBL4033700 0.78 ALDH1A1 (0.57) MEN1KMT2AMAPK10GFERCCNK
SCHEMBL4033484 0.77 MAPK10 (0.55) MEN1KMT2AMAPK10GFERCCNK
SCHEMBL1600146 0.77 MEN1 (0.57) MEN1KMT2AMAPK10GFERCCNK
SCHEMBL29454154 0.77 MEN1 (0.50) MEN1KMT2AMAPK10GFERCCNK
SCHEMBL22232308 0.77 MEN1 (0.50) MEN1KMT2AMAPK10GFERCCNK
SCHEMBL18199830 0.76 MEN1 (0.67) MEN1KMT2AMAPK10GFERCCNK
SCHEMBL4926590 0.74 MEN1 (0.55) MEN1KMT2AMAPK10GFERRAB9A
SCHEMBL25453078 0.74 CYP3A4 (0.50) MEN1KMT2AMAPK10GFERRAB9A
SCHEMBL6832802 0.74 MEN1 (0.55) MEN1KMT2AMAPK10GFERRAB9A

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
EP-1670787-B1 CYTOKINE INHIBITORS ITHERX PHARMA INC (US) 2012-05-30 EP disclosed
US-7919617-B2 Cytokine inhibitors iTherX Pharmaceuticals Inc. (US) 2011-04-05 US disclosed
US-7897599-B2 Cytokine inhibitors iTherX Pharmaceuticals Inc. (US) 2011-03-01 US disclosed
US-20100273797-A1 ALPHA-KETOAMIDES AND DERIVATIVES THEREOF ITHERX PHARMACEUTICALS, INC. 2010-10-28 US disclosed
US-7749999-B2 Alpha-ketoamides and derivatives thereof ITHERX PHARMACEUTICALS, INC. (US) 2010-07-06 US disclosed
US-20100093734-A1 CYTOKINE INHIBITORS ITHERX PHARMACEUTICALS, INC. (US) 2010-04-15 US disclosed
US-20100093735-A1 CYTOKINE INHIBITORS ITHERX PHARMACEUTICALS, INC. (US) 2010-04-15 US disclosed
EP-1670787-A4 CYTOKINE INHIBITORS KEMIA INC (US) 2009-04-22 EP disclosed
EP-1670787-A2 CYTOKINE INHIBITORS Kemia, INC. (US) 2006-06-21 EP disclosed
US-20050107399-A1 Cytokine inhibitors KEMIA, INC. 2005-05-19 US disclosed
WO-2005023761-A2 CYTOKINE INHIBITORS KEMIA, INC. (US) 2005-03-17 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-20050107399-A1 Cytokine inhibitors TNF, IL1RN, IL1A MEN1 4312/4885KMT2A 3812/4885MAPK10 587/4885
US-20100093734-A1 CYTOKINE INHIBITORS TNF, IL1RN, IL1A MEN1 4312/4885KMT2A 3812/4885MAPK10 587/4885
US-20100273797-A1 ALPHA-KETOAMIDES AND DERIVATIVES THEREOF TNF, IL1A, IL1B MEN1 4645/4885KMT2A 382/4885MAPK10 2068/4885
US-20100093735-A1 CYTOKINE INHIBITORS TNF, IL1RN, IL1A MEN1 4312/4885KMT2A 3812/4885MAPK10 587/4885

“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.