SCHEMBL5478964

SCHEMBL5478964

CN(C)C=CC(=O)c1cccc(CNCc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 2/20 0.60
▸ ALDH1A1 P00352 7/20 0.56
▸ MAPT P10636 7/20 0.56
▸ HTT P42858 4/20 0.56
▸ GAA P10253 3/20 0.56
▸ HPGD P15428 1/20 0.56
▸ RAB9A P51151 4/20 0.51
▸ POLB P06746 3/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ HSP90AA1 P07900 2/20 0.48
▸ KMT2A Q03164 1/20 0.46
▸ LMNA P02545 2/20 0.45
▸ BCHE P06276 1/20 0.44
▸ MYC P01106 1/20 0.44
▸ GPR52 Q9Y2T5 1/20 0.44
▸ MEP1B Q16820 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43

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
SCHEMBL9533855 0.86 RECQL (0.56) RECQLALDH1A1MAPTHTTGAA
SCHEMBL9533846 0.86 RECQL (0.56) RECQLALDH1A1MAPTHTTGAA
SCHEMBL5477573 0.80 MAPT (0.61) RECQLALDH1A1MAPTHTTGAA
SCHEMBL9530453 0.80 RECQL (0.55) RECQLALDH1A1MAPTHTTGAA
SCHEMBL5946453 0.79 MAPT (0.77) RECQLALDH1A1MAPTHTTGAA
SCHEMBL5480229 0.78 BCHE (0.62) RECQLALDH1A1MAPTHTTGAA
SCHEMBL446006 0.77 RECQL (1.00) RECQLALDH1A1MAPTHTTGAA
SCHEMBL425338 0.77 RECQL (1.00) RECQLALDH1A1MAPTHTTGAA
SCHEMBL29176317 0.77 RECQL (1.00) RECQLALDH1A1MAPTHTTGAA
SCHEMBL2961019 0.76 MAPT (0.53) RECQLALDH1A1MAPTHTTGAA

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-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors CYCLACEL LIMITED (GB) 2007-01-25 — — 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-20070021419-A1 2-Aminophenyl-4-phenylpyrimidines as kinase inhibitors GRK3, NCOR1, GRM3 RECQL 3742/4885ALDH1A1 4332/4885MAPT 4554/4885

“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.

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