SCHEMBL5116941

SCHEMBL5116941

C#Cc1ccsc1-c1nc2ccc(C)cn2c1NCC1CCCCC1.c1cc2cc-2c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.43
NR1H4 Q96RI1 7/20 0.41
PABPC1 P11940 1/20 0.41
GAA P10253 4/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ATM Q13315 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL5129077 0.88 ATM (0.43) ALOX5NR1H4GAAALDH1A1KDM4E
SCHEMBL5124142 0.85 ALDH1A1 (0.33) ALOX5GAAALDH1A1KDM4EMEN1
SCHEMBL5119833 0.85 GAA (0.40) GAAALDH1A1KDM4EMEN1KMT2A
SCHEMBL5128546 0.83 ALOX5 (0.41) ALOX5GAAALDH1A1KDM4EMEN1
SCHEMBL5122711 0.83 ALOX5 (0.41) ALOX5GAAALDH1A1KDM4EMEN1
SCHEMBL5124879 0.81 GAA (0.38) ALOX5GAAALDH1A1KDM4E
SCHEMBL5115175 0.81 TRPA1 (0.49) NR1H4GAAALDH1A1KDM4EMEN1
SCHEMBL5119529 0.79 NR1H4 (0.62) NR1H4GAAALDH1A1SMN1; SMN2ATM
SCHEMBL5128154 0.77 NR1H4 (0.59) NR1H4GAAALDH1A1KDM4ESMN1; SMN2
SCHEMBL5121835 0.76 NR1H4 (0.47) ALOX5NR1H4GAAALDH1A1KDM4E

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 ALOX5 4142/4885NR1H4 2683/4885PABPC1 3457/4885

“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.