SCHEMBL5633206

SCHEMBL5633206

Cc1cn2ccc(N(C)C)c(O)c2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 1/20 0.35
CHEK1 O14757 1/20 0.34
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34
JAK2 O60674 1/20 0.34
PRKD3 O94806 1/20 0.34
MAP4K4 O95819 1/20 0.34
PAK4 O96013 1/20 0.34
ABL1 P00519 1/20 0.34
NTRK1 P04629 1/20 0.34
LCK P06239 1/20 0.34
FYN P06241 1/20 0.34
CSF1R P07333 1/20 0.34
RET P07949 1/20 0.34
IGF1R P08069 1/20 0.34
MET P08581 1/20 0.34
PDGFRB P09619 1/20 0.34
PIM1 P11309 1/20 0.34
FGFR1 P11362 1/20 0.34
PDGFRA P16234 1/20 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
SCHEMBL5633757 0.80 SMPD3 (0.35) SMPD3
SCHEMBL5633143 0.79 ALDH1A1 (0.34) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL10435570 0.73 CHEK1 (0.43) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL4003688 0.68 ALDH1A1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
Bromide SCHEMBL2353004 0.67 ALDH1A1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL25103902 0.65 HTR6 (0.34)
SCHEMBL12432819 0.65 ALDH1A1 (0.38) SMPD3HDAC1PSEN1PSEN2APH1B
SCHEMBL31240925 0.65 L3MBTL1 (0.37) HDAC1PSEN1PSEN2APH1BNCSTN
SCHEMBL20085840 0.65 ALDH1A1 (0.38) HDAC1PSEN1PSEN2APH1BNCSTN
SCHEMBL25151349 0.65 ALDH1A1 (0.38) HDAC1PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930062-A1 Compositions containing imidazo-pyridine derivatives for dying keratinous fibres and process L'OREAL (FR) 1999-07-21 EP claimed
US-7196196-B2 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2007-03-27 US disclosed
US-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2005-01-27 US disclosed
US-5980585-A NONTOXIC; HAIR DYE L'OREAL (FR) 1999-11-09 US disclosed
EP-0930062-A1 Compositions containing imidazo-pyridine derivatives for dying keratinous fibres and process L'OREAL (FR) 1999-07-21 EP 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-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BTN3A1, DHPS, NISCH SMPD3 4780/4885CHEK1 3425/4885AURKA 862/4885

“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.