SCHEMBL4300645

SCHEMBL4300645

C[C](C)Cc1nc(C=O)cs1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.40
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL972897 0.80 ALDH1A1 (0.49) HTR2BMAPTALDH1A1RAB9AL3MBTL1
SCHEMBL9381967 0.79 SLC6A3 (0.39) HTR2BMAPTALDH1A1KDM4E
SCHEMBL5774433 0.79
SCHEMBL10771875 0.79
SCHEMBL2435123 0.74 MAPT (0.45) HTR2BMAPTALDH1A1RAB9AL3MBTL1
SCHEMBL5778309 0.74 CNR2 (0.40) HTR2BMAPTALDH1A1
SCHEMBL28787644 0.73 SLC6A3 (0.42) HTR2BMAPTALDH1A1KDM4E
SCHEMBL9381732 0.71 ECE1 (0.38) HTR2BMAPTALDH1A1KDM4E
SCHEMBL25129991 0.70 HTR2B (0.37) HTR2BMAPTALDH1A1
SCHEMBL16398633 0.70 ECE1 (0.40) HTR2BMAPTALDH1A1KDM4EHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981884-B1 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS AMGEN INC (US) 2012-06-13 EP disclosed
US-8084479-B2 Thiazole compounds and methods of use AMGEN INC. (US) 2011-12-27 US disclosed
US-20090270445-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2009-10-29 US disclosed
US-7514566-B2 Thiazole compounds and methods of use AMGEN, INC. (US) 2009-04-07 US disclosed
EP-1981884-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS Amgen, Inc (US) 2008-10-22 EP disclosed
WO-2007084391-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B ( PKB) INHIBITORS AMGEN INC. (US) 2007-07-26 WO disclosed
US-20070173506-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2007-07-26 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-20090270445-A1 Thiazole compounds and methods of use MTOR, JAK2, TK2 HTR2B 1858/4885MAPT 2665/4885ALDH1A1 2019/4885
US-20070173506-A1 Thiazole compounds and methods of use MTOR, JAK2, PCK2 HTR2B 2570/4885MAPT 2718/4885ALDH1A1 2061/4885

“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.