SCHEMBL5115119

SCHEMBL5115119

C#Cc1ccsc1-c1nc2cc(-c3ccccc3)ccn2c1Nc1ccc(F)c(Cl)c1.c1cc2cc-2c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.38
GAA P10253 6/20 0.37
MAPT P10636 5/20 0.37
TP53 P04637 4/20 0.37
ABCG2 Q9UNQ0 1/20 0.36
CDK2 P24941 1/20 0.34
MAPKAPK2 P49137 1/20 0.34
BRD4 O60885 1/20 0.34
GRM4 Q14833 1/20 0.33
TDO2 P48775 1/20 0.33
FLT3 P36888 1/20 0.33
EGFR P00533 1/20 0.33
MAP3K8 P41279 1/20 0.33
POLB P06746 1/20 0.33
ACP1 P24666 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL5118180 0.89 TRPA1 (0.40) BRAFGAAMAPTTP53ABCG2
SCHEMBL5121637 0.76 NR1H4 (0.41) GAAMAPTTP53BRD4POLB
SCHEMBL5118244 0.76 TRPA1 (0.38) GAAMAPTTP53BRD4SMN1; SMN2
SCHEMBL5115114 0.75 EGFR (0.41) BRAFGAAMAPTTP53ABCG2
SCHEMBL5113724 0.74 NR1H4 (0.35) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL5129230 0.72 NR1H4 (0.44) GAAMAPTTP53BRD4POLB
SCHEMBL5113157 0.71 NR1H4 (0.42) GAAMAPTTP53SMN1; SMN2
SCHEMBL5128014 0.71 NR1H4 (0.49) GAAMAPTPOLBSMN1; SMN2
SCHEMBL5117932 0.71 GAA (0.51) BRAFGAAMAPTTP53SMN1; SMN2
SCHEMBL5127031 0.70 ALDH1A1 (0.50) GAAMAPTTP53POLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1791840-B1 SUBSTITUTED BICYCLIC IMIDAZO-3-YLAMINE COMPOUNDS GRUENENTHAL GMBH (DE) 2013-11-27 EP claimed
US-7420056-B2 Substituted bicyclic imidazo-3-ylamine compounds GRUENENTHAL GMBH (DE) 2008-09-02 US claimed
US-20070155965-A1 SUBSTITUTED BICYCLIC IMIDAZO-3-YLAMINE COMPOUNDS GRUENENTHAL GMBH. (DE) 2007-07-05 US claimed
US-7420056-B2 Substituted bicyclic imidazo-3-ylamine compounds GRUENENTHAL GMBH (DE) 2008-09-02 US disclosed
US-20070155965-A1 SUBSTITUTED BICYCLIC IMIDAZO-3-YLAMINE COMPOUNDS GRUENENTHAL GMBH. (DE) 2007-07-05 US 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-20070155965-A1 SUBSTITUTED BICYCLIC IMIDAZO-3-YLAMINE COMPOUNDS AADAC, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, PAICS BRAF 2413/4885GAA 234/4885MAPT 707/4885

“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.