SCHEMBL2984593

SCHEMBL2984593

CSc1ncc(Cl)c(-c2nnc(Nc3ccc(F)cc3)s2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 2/20 0.42
CDK2 P24941 2/20 0.42
MAPT P10636 5/20 0.41
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
MAPK14 Q16539 1/20 0.38
ALDH1A1 P00352 3/20 0.37
CTSC P53634 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
MAPK9 P45984 1/20 0.35
MAPK10 P53779 1/20 0.35
GSK3B P49841 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GUSB P08236 2/20 0.35

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
SCHEMBL5213721 0.83 MAPT (0.48) MAPTALDH1A1LMNATP53NPC1
SCHEMBL2980177 0.68 ALDH1A1 (0.40) MAPTALDH1A1LMNATP53THRB
SCHEMBL6155925 0.68 GUSB (0.70) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL28569839 0.65 ALDH1A1 (0.50) MAPTALDH1A1LMNANPC1RAB9A
SCHEMBL28574645 0.64 HDAC6 (0.61) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL4824670 0.64 CCNA2 (0.47) CCNA2CDK2MAPTLMNATP53
SCHEMBL27543853 0.64 KDM4E (0.70) CCNA2CDK2MAPTALDH1A1LMNA
SCHEMBL4601670 0.63 MAPK13 (0.53) MAPTMAPK13MAPK12MAPK11MAPK14
SCHEMBL6344153 0.63 HTT (0.46) CCNA2CDK2MAPTLMNATP53
SCHEMBL6923416 0.62 CTSC (0.53) CTSCMAPK9MAPK10

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-1831207-B1 AMINOPYRIMIDINE COMPOUNDS AS PLK INHIBITORS AMGEN INC (US) 2012-11-14 EP disclosed
US-7858785-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-12-28 US disclosed
US-7786132-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-08-31 US disclosed
US-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-01-14 US disclosed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 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 (2 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-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE PLK1, TYMP, TK2 CCNA2 133/4885CDK2 23/4885MAPT 1412/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 CCNA2 133/4885CDK2 23/4885MAPT 1412/4885

“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.