SCHEMBL4520299

SCHEMBL4520299

CCC(N)CNc1ccnc(-c2cc(-c3ccc(C)cc3)ccc2O)n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 2/20 0.72
PRKD1 Q15139 2/20 0.72
PRKD2 Q9BZL6 2/20 0.72
CLK1 P49759 1/20 0.39
CLK4 Q9HAZ1 5/20 0.38
HRH3 Q9Y5N1 1/20 0.38
DYRK1A Q13627 2/20 0.36
CYP1A2 P05177 6/20 0.35
CYP3A4 P08684 5/20 0.35
CYP2C19 P33261 5/20 0.35
CYP2D6 P10635 3/20 0.35
MAPKAPK2 P49137 1/20 0.35
CYP2C9 P11712 1/20 0.35
FDPS P14324 1/20 0.34
ALDH1A1 P00352 5/20 0.34
MAPK1 P28482 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
HSD17B10 Q99714 3/20 0.34
HPGD P15428 2/20 0.34
LMNA P02545 2/20 0.34

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
SCHEMBL4520294 1.00 PRKD3 (0.72) PRKD3PRKD1PRKD2CLK1CLK4
SCHEMBL4520292 1.00 PRKD3 (0.72) PRKD3PRKD1PRKD2CLK1CLK4
SCHEMBL4511350 0.93 PRKD3 (0.74) PRKD3PRKD1PRKD2CLK4HRH3
SCHEMBL4511344 0.93 PRKD3 (0.74) PRKD3PRKD1PRKD2CLK4HRH3
SCHEMBL4511341 0.93 PRKD3 (0.74) PRKD3PRKD1PRKD2CLK4HRH3
SCHEMBL4512527 0.92 PRKD3 (0.72) PRKD3PRKD1PRKD2CLK4HRH3
SCHEMBL4523068 0.92 PRKD3 (0.72) PRKD3PRKD1PRKD2CLK4HRH3
SCHEMBL4512523 0.92 PRKD3 (0.72) PRKD3PRKD1PRKD2CLK4HRH3
SCHEMBL4512516 0.92 PRKD3 (0.72) PRKD3PRKD1PRKD2CLK4HRH3
SCHEMBL4523059 0.92 PRKD3 (0.72) PRKD3PRKD1PRKD2CLK4HRH3

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-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-10-01 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-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE PKD2, PKD1, AADAT PRKD3 9/4885PRKD1 49/4885PRKD2 18/4885

“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.