SCHEMBL10139873

SCHEMBL10139873

O=C(Nc1ccc(Cl)cc1)N1CCc2[nH]c3ncc(Cl)cc3c2C1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.69
KMT2A Q03164 3/20 0.69
MAPT P10636 2/20 0.69
CYP1A2 P05177 1/20 0.69
CYP3A4 P08684 1/20 0.69
CYP2D6 P10635 1/20 0.69
CYP2C9 P11712 1/20 0.69
CYP2C19 P33261 1/20 0.69
MCL1 Q07820 1/20 0.69
TRPV1 Q8NER1 7/20 0.57
CHEK1 O14757 1/20 0.56
ABL1 P00519 1/20 0.56
MET P08581 1/20 0.56
PIM1 P11309 1/20 0.56
FGFR1 P11362 1/20 0.56
LTK P29376 1/20 0.56
MAPK8 P45983 1/20 0.56
CDK8 P49336 1/20 0.56
GSK3B P49841 1/20 0.56
CDK9 P50750 1/20 0.56

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
SCHEMBL10139863 0.90 MAPT (0.56) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL10139868 0.90 MEN1 (0.56) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL10139888 0.89 MEN1 (0.57) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL10139825 0.85 BAZ2B (0.53) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL10139927 0.85 MEN1 (0.58) MEN1KMT2AMAPTCYP1A2CYP3A4
Hydrochloric Acid SCHEMBL407664 0.84 BAZ2B (0.52) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL10139880 0.84 MEN1 (0.56) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL408088 0.83 BAZ2B (0.52) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL18106968 0.82 MAPT (0.47) MEN1KMT2AMAPTCYP1A2CYP3A4
SCHEMBL10139886 0.81 MAPT (0.77) MEN1KMT2AMAPTCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 MEN1 3463/4885KMT2A 1887/4885MAPT 2520/4885

“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.