SCHEMBL406672

SCHEMBL406672

N#Cc1ccc(S(=O)(=O)N2CCc3[nH]c4ncc(Cl)cc4c3C2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.62
CCR6 P51684 3/20 0.43
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTR6 P50406 1/20 0.39
CNR1 P21554 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
PKM P14618 1/20 0.38
PKLR P30613 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CYP3A4 P08684 1/20 0.37
GRM5 P41594 1/20 0.37
IKBKB O14920 1/20 0.36
CHUK O15111 1/20 0.36
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36

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
SCHEMBL409007 0.90 MAPT (0.48) MAPTL3MBTL1HTR6KMT2A
SCHEMBL403561 0.90 MAPT (0.50) MAPTHTR6JAK2JAK1CCNT1
SCHEMBL409053 0.84 PKM (0.47) MAPTHTR6CNR1PKMPKLR
SCHEMBL10139897 0.83 MEN1 (0.46) MAPTHTR6TDP1KMT2A
SCHEMBL13284248 0.80 MAPT (0.40) MAPTHTR6TDP1PKMPKLR
SCHEMBL408384 0.79 KDM4E (0.39) MAPTHTR6PKM
SCHEMBL10139841 0.78 CFTR (0.49) MAPTGAAKMT2ANPSR1CYP3A4
SCHEMBL409117 0.78 MAPT (0.45) MAPTHTR6PKMPKLR
Hydrochloric Acid SCHEMBL409052 0.78 CFTR (0.51) MAPTGAAJAK1KMT2ANPSR1
SCHEMBL10139868 0.77 MEN1 (0.56) MAPTGAAKMT2ANPSR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367822-B1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2016-10-05 EP claimed
US-8853391-B2 Tricyclic azaindoles MERCK PATENT GMBH (DE) 2014-10-07 US claimed
US-20120022060-A1 Tricyclic Azaindoles MERCK PATENT GMBH (DE) 2012-01-26 US claimed
EP-2367822-A1 TRICYCLIC AZAINDOLES Merck Patent GmbH (DE) 2011-09-28 EP claimed
WO-2010080253-A1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2010-07-15 WO claimed
EP-2367822-B1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2016-10-05 EP disclosed
US-8853391-B2 Tricyclic azaindoles MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-8853391-B2 Tricyclic azaindoles MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-8853391-B2 Tricyclic azaindoles MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-20120022060-A1 Tricyclic Azaindoles MERCK PATENT GMBH (DE) 2012-01-26 US disclosed
US-20120022060-A1 Tricyclic Azaindoles MERCK PATENT GMBH (DE) 2012-01-26 US disclosed
US-20120022060-A1 Tricyclic Azaindoles MERCK PATENT GMBH (DE) 2012-01-26 US disclosed
WO-2010080253-A1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2010-07-15 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-20120022060-A1 Tricyclic Azaindoles AZI2, DCK, PPP2CA MAPT 2520/4885CCR6 3105/4885GAA 3108/4885

“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.