SCHEMBL3552242

SCHEMBL3552242

COCCC(=O)N1CC[N]CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ATM Q13315 1/20 0.38
GLA P06280 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TGM2 P21980 1/20 0.36
SMO Q99835 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL10404896 0.82 ATM (0.58) HPGDSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL12518836 0.80 HPGD (0.58) HPGDSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL188061 0.80 ALDH1A1 (0.45) HPGDSMN1; SMN2GAAALDH1A1KMT2A
SCHEMBL3551854 0.79 TDP1 (0.43) HPGDSMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL26296344 0.78 TDP1 (0.45) HPGDSMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL13779982 0.78 KDM4E (0.49) HPGDSMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL4143426 0.78 L3MBTL1 (0.48) HPGDSMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL11583273 0.77 KDM4E (0.39) HPGDSMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL23135854 0.77 GLA (0.62) HPGDSMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL12706397 0.77 ALDH1A1 (0.42) HPGDSMN1; SMN2GAAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655652-B2 2-{4-[4-(2-hydroxyacetyl)piperazin-1-yl]anilino}-4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)-5-fluoropyrimidine hydrochloride; cell cycle inhibitory; rheumatoid arthritis ASTRAZENECA AB (SE) 2010-02-02 US disclosed
US-20070161615-A1 Chemical compounds ASTRAZENECA AB (SE) 2007-07-12 US disclosed
EP-1748999-A1 IMIDAZOLO-5-YL-2-ANILINOPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2007-02-07 EP disclosed
WO-2005075461-A1 IMIDAZOLO-5-YL-2-ANILINOPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2005-08-18 WO 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-20070161615-A1 Chemical compounds MKI67, PCNA, CCNI HPGD 552/4885SMN1; SMN2 2427/4885GAA 64/4885

“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.