SCHEMBL6416630

SCHEMBL6416630

CCCCC(=O)C(C)C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.41
CES1 P23141 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.39
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
FAAH O00519 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL3821988 0.94 CES2 (0.48) CES2CES1MAPTLMNAMEN1
SCHEMBL6067582 0.92 CES2 (0.52) CES2MAPTLMNAMEN1FAAH
SCHEMBL4939835 0.87 ALDH1A1 (0.40) CES2CES1ALDH1A1LMNAKMT2A
SCHEMBL7209898 0.83 CA1 (0.47) CES2CES1MAPTLMNAMEN1
SCHEMBL11852256 0.82 KMT2A (0.36) CES2ALDH1A1MAPTKMT2A
SCHEMBL7915536 0.82 CES2 (0.52) CES2CES1ALDH1A1MEN1FAAH
SCHEMBL31513291 0.82 LMNA (0.50) CES2CES1ALDH1A1MAPTLMNA
SCHEMBL11060292 0.79 CYP1A2 (0.45) ALDH1A1LMNAKMT2A
SCHEMBL17021264 0.79 GABRP (0.40) ALDH1A1LMNAMEN1KMT2A
SCHEMBL1148993 0.78 SOAT1 (0.46) ALDH1A1LMNAMEN1KMT2A

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
US-6951866-B2 Bicyclic pyrimidine compounds and therapeutic use thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-10-04 US disclosed
EP-1110951-B1 PYRIMIDINE DERIVATIVES SUMITOMO PHARMA (JP) 2004-05-19 EP disclosed
US-20030105323-A1 Pyrimidine derivative SUMITOMO PHARMACEUTICALS COMPANY LIMITED 2003-06-05 US disclosed
US-6458798-B1 HAS AN INHIBITORY ACTIVITY OF PRODUCTION OF TH2 TYPE CYTOKINES SUCH AS IL-4, IL-5, ETC., AND IS USEFUL AS AN THERAPEUTIC AGENT FOR ALLERGIC DISEASES, AUTOIMMUNE DISEASES SUCH AS SYSTEMIC LUPUS ERYTHEMATHOSUS, ETC., AND ACQUIRED SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-10-01 US disclosed
EP-1110951-A1 PYRIMIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-06-27 EP 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-20030105323-A1 Pyrimidine derivative IL5, IL4, IL15 CES2 4513/4885CES1 3233/4885ALDH1A1 1331/4885

“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.