SCHEMBL4864428

SCHEMBL4864428

Cc1ccc2nc(N)c(N)cc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCK1 P16333 1/20 0.57
BACE1 P56817 1/20 0.57
CYP1A2 P05177 3/20 0.50
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PSMB5 P28074 1/20 0.44
RAB9A P51151 4/20 0.44
MAPT P10636 3/20 0.44
NPC1 O15118 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
ALDH1A1 P00352 4/20 0.42
CYP2A6 P11509 2/20 0.42
PDE3B Q13370 2/20 0.42
PDE3A Q14432 2/20 0.42
NQO2 P16083 1/20 0.42

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
SCHEMBL17942650 0.83 NCK1 (0.57) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL14702032 0.83 NCK1 (0.57) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL22509690 0.80 NCK1 (0.53) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL22509757 0.80 NCK1 (0.53) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL22509834 0.80 NCK1 (0.53) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL20377250 0.80 NCK1 (0.53) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL22509688 0.77 TLR8 (0.64) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL2371400 0.77 CYP1A2 (0.62) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL807478 0.76 KDM4E (0.62) NCK1BACE1CYP1A2MEN1KMT2A
SCHEMBL15241793 0.76 NQO2 (0.64) NCK1BACE1CYP1A2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390819-B2 Imidazo[4,5-b]quinoline-derivatives and their use as no-synthase inhibitors ALTANA PHARMA AG (DE) 2008-06-24 US disclosed
EP-1599473-B1 IMIDAZO 4,5-B QUINOLINE-DERIVATIVES AND THEIR USE AS NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2006-09-20 EP disclosed
US-20060160839-A1 Imidazo[4,5-b]quinoline-derivatives and their use as no-synthase inhibitors ALTANA PHARMA AG (DE) 2006-07-20 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-20060160839-A1 Imidazo[4,5-b]quinoline-derivatives and their use as no-synthase inhibitors NOS2, NOS1, NOS3 NCK1 3668/4885BACE1 2284/4885CYP1A2 12/4885

“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.