SCHEMBL3083393

SCHEMBL3083393

O=[C]N1CCN(C2CCCC2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
HSD17B10 Q99714 1/20 0.40
PHGDH O43175 1/20 0.39
MGLL Q99685 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 1/20 0.39
SIGMAR1 Q99720 3/20 0.37
L3MBTL3 Q96JM7 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KCNH2 Q12809 2/20 0.36
HRH3 Q9Y5N1 2/20 0.36
KDM4E B2RXH2 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
SCHEMBL2318961 0.98 POLB (0.43) POLBHSD17B10PHGDHMGLLMEN1
SCHEMBL1543397 0.90 ALDH1A1 (0.32) POLBHSD17B10MEN1KMT2AALDH1A1
SCHEMBL27838704 0.89 L3MBTL3 (0.34) POLBHSD17B10PHGDHMGLLMEN1
SCHEMBL1306348 0.81 L3MBTL3 (0.43) ALDH1A1L3MBTL3L3MBTL1
SCHEMBL1784012 0.80 L3MBTL1 (0.41) ALDH1A1L3MBTL3L3MBTL1
SCHEMBL1711609 0.79 L3MBTL3 (0.43) MEN1KMT2AALDH1A1L3MBTL3L3MBTL1
SCHEMBL19034085 0.79
SCHEMBL13942560 0.79 PHGDH (0.52) POLBHSD17B10PHGDHMGLLMEN1
SCHEMBL24302231 0.76 PHGDH (0.56) POLBHSD17B10PHGDHMGLLMEN1
SCHEMBL584039 0.76

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-7790720-B2 Compounds comprising an oxazole or thiazole moiety, processes for making them, and their uses UCB PHARMA, S.A. (BE) 2010-09-07 US disclosed
US-20080275046-A1 Compounds Comprising an Oxazole or Thiazole Moiety, Processes for Making Them, and Their Uses UCB PHARMA, S.A. (BE) 2008-11-06 US disclosed
EP-0714909-A1 Composition for prophylaxis or treatment of pulmonary circulatory diseases Takeda Chemical Industries, Ltd. (JP) 1996-06-05 EP disclosed
EP-0647449-A1 Sustained-release preparation of anti-endothelin substance Takeda Chemical Industries, Ltd. (JP) 1995-04-12 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-20080275046-A1 Compounds Comprising an Oxazole or Thiazole Moiety, Processes for Making Them, and Their Uses OXER1, OXTR, OGFR POLB 3930/4885HSD17B10 920/4885PHGDH 3653/4885

“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.