SCHEMBL3247377

SCHEMBL3247377

CC(C)(C)OC(=O)NC1=NC(c2ccncc2)(c2cccc(O)c2)c2cccnc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.37
CYP17A1 P05093 4/20 0.36
METAP1 P53582 1/20 0.33
NAMPT P43490 1/20 0.33
TDP2 O95551 3/20 0.33
ATR Q13535 1/20 0.32
LCK P06239 2/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
BACE1 P56817 2/20 0.31
CTSD P07339 1/20 0.31
BACE2 Q9Y5Z0 1/20 0.31
NQO2 P16083 1/20 0.31
RAB9A P51151 1/20 0.30
KCNH2 Q12809 1/20 0.30
AAK1 Q2M2I8 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
SCHEMBL3359222 0.89 SYK (0.38) SYKMETAP1TDP2ATRLCK
SCHEMBL3248773 0.88 BACE1 (0.37) SYKMETAP1ATRBACE1KCNH2
SCHEMBL3357372 0.74 TDP2 (0.35) TDP2
SCHEMBL2085499 0.70 BACE1 (0.36) SYKLCKHCRTR1HCRTR2BACE1
SCHEMBL3247384 0.70 BUB1 (0.33) SYKCYP17A1
SCHEMBL2086590 0.65 NPC1 (0.37) BACE1CTSDBACE2RAB9A
SCHEMBL3239035 0.63 BACE1 (0.52) SYKBACE1BACE2KCNH2
SCHEMBL29764154 0.63 SYK (0.60) SYKCYP17A1NAMPTRAB9A
SCHEMBL526864 0.63 SYK (0.60) SYKCYP17A1NAMPTRAB9A
SCHEMBL334709 0.61 CYP17A1 (0.68) CYP17A1NAMPT

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-20100125087-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 US disclosed
WO-2010056195-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 WO disclosed
US-20100125087-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 US disclosed
US-20100125087-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 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-20100125087-A1 NEW COMPOUNDS 575 PSEN1, PSEN2, BACE1 SYK 2212/4885CYP17A1 1934/4885METAP1 3276/4885

“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.