SCHEMBL4872303

SCHEMBL4872303

CC(C)(C)OC(=O)c1ccc(Nc2cncnc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.50
NAMPT P43490 2/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
STAT3 P40763 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
ABL1 P00519 5/20 0.39
CYP17A1 P05093 1/20 0.39
KCNH2 Q12809 1/20 0.37
BCAT2 O15382 1/20 0.37
TP53 P04637 1/20 0.37
THRB P10828 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL25469660 0.84 ABCG2 (0.52) ABCG2NAMPTCA12CA1CA2
SCHEMBL3129375 0.80 CA1 (0.51) ABCG2NAMPTCA12CA1CA2
SCHEMBL28896283 0.78 HCAR2 (0.46) ABCG2NAMPTCA12CA1CA2
SCHEMBL4875132 0.77 RAB9A (0.49) ABCG2NAMPTMEN1KMT2AKDM4E
SCHEMBL8321484 0.77 NPC1 (0.51) MEN1KMT2ARXFP1BCAT2TP53
SCHEMBL109451 0.76 CA1 (0.61) ABCG2CA12CA1CA2CA9
SCHEMBL2344970 0.75 CA1 (0.50) ABCG2CA12CA1CA2CA9
SCHEMBL18025996 0.75 CA1 (0.50) ABCG2CA12CA1CA2CA9
SCHEMBL4872573 0.75 HCAR2 (0.54) BCAT2TP53RAB9A
SCHEMBL4875486 0.74 BCAT2 (0.43) NAMPTBCAT2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080076771-A1 Thrombopoietin Receptor Agonists REITER LAWRENCE A 2008-03-27 US disclosed
EP-1794156-A2 TROMBOPOIETIN RECEPTOR AGONISTS Pfizer Products Incorporated (US) 2007-06-13 EP disclosed
WO-2006033005-A2 THROMBOPOIETIN RECEPTOR AGONISTS PFIZER PRODUCTS INC. (US) 2006-03-30 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-20080076771-A1 Thrombopoietin Receptor Agonists MPL, THPO, TBXA2R ABCG2 3896/4885NAMPT 4485/4885CA12 4856/4885

“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.