SCHEMBL2527124

SCHEMBL2527124

C1=CNC(c2cnc3ccccc3c2)N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
MGAM O43451 1/20 0.46
SLC6A4 P31645 1/20 0.46
ALDH1A1 P00352 3/20 0.45
KDR P35968 1/20 0.43
PDGFRB P09619 3/20 0.42
PDGFRA P16234 3/20 0.42
TOP2A P11388 1/20 0.41
TOP2B Q02880 1/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.40
CYP2A6 P11509 1/20 0.40
NISCH Q9Y2I1 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MITF O75030 1/20 0.39
XBP1 P17861 1/20 0.39

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
SCHEMBL17785558 0.74 KDM4E (0.56) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB
SCHEMBL27684370 0.73 CYP1A2 (0.48) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB
SCHEMBL5974206 0.73 SLC6A4 (0.50) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB
SCHEMBL4405510 0.72 SLC6A4 (0.41) CYP1A2MGAMSLC6A4ALDH1A1KDR
SCHEMBL13991760 0.71 SLC6A4 (0.52) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB
SCHEMBL3088721 0.71 PSMB5 (0.61) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB
SCHEMBL19606347 0.71 PSMB5 (0.57) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB
SCHEMBL2207389 0.71 SLC18A3 (0.50) CYP1A2SLC6A4PDGFRBPDGFRANISCH
SCHEMBL17186138 0.70 CYP1A2 (0.50) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB
SCHEMBL30824505 0.70 SLC6A4 (0.48) CYP1A2MGAMSLC6A4ALDH1A1PDGFRB

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-8431592-B2 1,3-dihydro-imidazo[4,5-c]quinolin-2-ones as lipid kinase inhibitors NOVARTIS AG (CH) 2013-04-30 US disclosed
US-20110251202-A1 1,3-Dihydro-imidazo[4,5-c]quinolin-2-ones as Lipid Kinase Inhibitors NOVARTIS AG (CH) 2011-10-13 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-20110251202-A1 1,3-Dihydro-imidazo[4,5-c]quinolin-2-ones as Lipid Kinase Inhibitors PDPK1, PI4KA, PIP4K2A CYP1A2 677/4885MGAM 3685/4885SLC6A4 4796/4885

“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.