SCHEMBL6071067

SCHEMBL6071067

N#Cc1cc2ccccc2nc1NCCN1CCOCC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.63
CYP1A2 P05177 3/20 0.61
CYP3A4 P08684 3/20 0.61
CYP2D6 P10635 3/20 0.61
CLK4 Q9HAZ1 3/20 0.61
CYP2C19 P33261 2/20 0.61
TOP2A P11388 1/20 0.57
MAPK1 P28482 2/20 0.56
LMNA P02545 2/20 0.56
MAPT P10636 1/20 0.56
RAB9A P51151 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
ALDH1A1 P00352 8/20 0.56
HSD17B10 Q99714 4/20 0.56
USP2 O75604 1/20 0.56
KDM4E B2RXH2 7/20 0.55
GAA P10253 3/20 0.55
HPGD P15428 4/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.54

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
SCHEMBL7094353 0.78 KDM4E (0.49) MAPK1LMNAMAPTRAB9ATDP1
Bazinaprine SCHEMBL499295 0.77 ACHE (1.00) ACHECYP1A2CYP3A4CYP2D6CLK4
Bazinaprine SCHEMBL10830678 0.76 ACHE (0.98) ACHECYP1A2CYP3A4CYP2D6CLK4
SCHEMBL19051440 0.75 RXFP1 (0.65) MAPK1LMNAMAPTRAB9ATDP1
SCHEMBL7519805 0.75 KMT2A (0.59) ACHECYP1A2CYP3A4CYP2D6CLK4
SCHEMBL1256953 0.74 ACHE (0.56) ACHECYP1A2CYP3A4CYP2D6CLK4
SCHEMBL31060861 0.74 TOP2A (0.65) CYP1A2CYP3A4CYP2D6CLK4CYP2C19
SCHEMBL9208466 0.74 LMNA (0.62) ACHECYP1A2CYP3A4CYP2D6TOP2A
SCHEMBL17254999 0.73 ALDH1A1 (0.59) ACHECYP1A2CYP3A4CYP2D6CLK4
SCHEMBL18057384 0.72 ALDH1A1 (0.57) ACHECYP1A2CYP3A4CYP2D6CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2006-11-23 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-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same TNNI3K, CSNK1A1L, CDKL1 ACHE 1541/4885CYP1A2 1959/4885CYP3A4 2706/4885

“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.