SCHEMBL14569050

SCHEMBL14569050

Cc1ccccc1-c1ccc2nc(N[C@H]3CC[C@H](N)CC3)ncc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.56
KDR P35968 4/20 0.56
MAPK14 Q16539 4/20 0.56
JAK3 P52333 2/20 0.56
RIPK2 O43353 1/20 0.53
USP2 O75604 1/20 0.52
LMNA P02545 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
TSHR P16473 1/20 0.52
CYP2C19 P33261 1/20 0.52
CLK4 Q9HAZ1 1/20 0.52
CDK9 P50750 6/20 0.48
CCNT1 O60563 1/20 0.48
FLT3 P36888 1/20 0.48
MAPK10 P53779 3/20 0.47
MAPK8 P45983 1/20 0.47
BACE1 P56817 3/20 0.46
CTSD P07339 1/20 0.46

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
SCHEMBL5492036 1.00 LCK (0.56) LCKKDRMAPK14JAK3RIPK2
SCHEMBL14569053 0.89 RIPK2 (0.64) LCKKDRMAPK14JAK3RIPK2
SCHEMBL5492979 0.89 RIPK2 (0.64) LCKKDRMAPK14JAK3RIPK2
SCHEMBL5490369 0.87 ABL1 (0.47) LCKKDRMAPK14JAK3RIPK2
SCHEMBL5490366 0.87 ABL1 (0.47) LCKKDRMAPK14JAK3RIPK2
SCHEMBL5497262 0.84 RIPK2 (0.48) LCKKDRMAPK14JAK3RIPK2
SCHEMBL5497259 0.84 RIPK2 (0.48) LCKKDRMAPK14JAK3RIPK2
SCHEMBL1517393 0.81 CCNE1 (0.53) LCKKDRMAPK14JAK3CDK9
SCHEMBL14569075 0.81 MAPK14 (0.63) LCKKDRMAPK14JAK3MAPK10
SCHEMBL5494066 0.81 ACHE (0.48) LCKKDRMAPK14JAK3LMNA

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-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 US disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 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-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use MAP3K1, MAP3K5, MAP3K2 LCK 106/4885KDR 1044/4885MAPK14 301/4885

“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.