SCHEMBL202473

SCHEMBL202473

CC1CCc2nc3cnc4ccccc4c3n2N1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
GABRA1 P14867 1/20 0.35
GABRA2 P47869 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
LRRK2 Q5S007 6/20 0.34
KDM4E B2RXH2 1/20 0.34
GPR3 P46089 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
CASP1 P29466 1/20 0.33
CASP3 P42574 1/20 0.33
CASP8 Q14790 1/20 0.33
SSTR2 P30874 1/20 0.33
GRM5 P41594 1/20 0.33

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
SCHEMBL1773860 0.69 KDM4E (0.34) TLR7KDM4EGPR3SMN1; SMN2LMNA
SCHEMBL204000 0.69 KDM4E (0.39) ALDH1A1GABRA1GABRA2TLR7KDM4E
SCHEMBL202424 0.67 KDM4E (0.38) ALDH1A1TLR7KDM4EGPR3SMN1; SMN2
SCHEMBL205008 0.67 KDM4E (0.37) ALDH1A1TLR7KDM4EGPR3SSTR2
SCHEMBL202597 0.67 KDM4E (0.37) ALDH1A1TLR7LRRK2KDM4EGPR3
SCHEMBL1774813 0.66 JAK1 (0.35) SMN1; SMN2GRM5
SCHEMBL1774815 0.66 ALDH1A1 (0.34) ALDH1A1KDM4EGPR3GRM5
SCHEMBL203276 0.66 CYP3A4 (0.36) ALDH1A1TLR7KDM4EGPR3SMN1; SMN2
SCHEMBL203764 0.66 CYP3A4 (0.36) ALDH1A1TLR7KDM4EGPR3SMN1; SMN2
SCHEMBL10123167 0.66 KDM4E (0.43) ALDH1A1KDM4ESMN1; SMN2LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088788-B2 Substituted fused[1,2] imidazo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-03 US disclosed
US-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS PFIZER INC. 2009-09-03 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-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS IL2, IFNG, IL4 ALDH1A1 979/4885GABRA1 1671/4885GABRA2 1665/4885

“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.