SCHEMBL13651663

SCHEMBL13651663

Cn1cnc(O)c1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 4/20 0.41
APOBEC3G Q9HC16 3/20 0.41
MEN1 O00255 1/20 0.37
PABPC1 P11940 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
DPP4 P27487 2/20 0.33
CTDSP1 Q9GZU7 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32
KDR P35968 1/20 0.31
MAPT P10636 1/20 0.30
CDK1 P06493 1/20 0.30
CCNB1 P14635 1/20 0.30
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL2202785 0.79 APOBEC3A (0.41) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL19797901 0.79 APOBEC3A (0.41) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL13030147 0.79 APOBEC3A (0.49) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL28415122 0.78 APOBEC3A (0.40) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL11503590 0.76 ADORA2A (0.38) ALDH1A1LMNAMAPTCDK1CCNB1
SCHEMBL926257 0.75 APOBEC3A (0.38) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL1665829 0.75 APOBEC3A (0.38) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL18256648 0.75 YTHDC1 (0.40) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A
SCHEMBL11760109 0.72 KDM4E (0.54) KMT2AALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11546917 0.71 ALDH1A1 (0.46) APOBEC3AAPOBEC3GMEN1PABPC1KMT2A

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-8329738-B2 Use of AMPK-activating imidazole derivatives, preparation process therefor and pharmaceutical compositions comprising them MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2012-12-11 US disclosed
US-20090253764-A1 USE OF AMPK-ACTIVATING IMIDAZOLE DERIVATIVES, PREPARATION PROCESS THEREFOR AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM MERCK PATENT GESELLSCHAFT (DE) 2009-10-08 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-20090253764-A1 USE OF AMPK-ACTIVATING IMIDAZOLE DERIVATIVES, PREPARATION PROCESS THEREFOR AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PRKAG1, PRKAB1, PRKAG2 APOBEC3A 4327/4885APOBEC3G 4031/4885MEN1 2825/4885

“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.