SCHEMBL3078766

SCHEMBL3078766

[CH2]N1CCC[C@H]1CN1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.36
BRD4 O60885 2/20 0.34
BRD2 P25440 2/20 0.34
BRD3 Q15059 2/20 0.34
BRDT Q58F21 2/20 0.34
DPP4 P27487 1/20 0.33
USP2 O75604 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
CYP1A2 P05177 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 3/20 0.31
KEAP1 Q14145 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
UTS2R Q9UKP6 1/20 0.31
SIGMAR1 Q99720 2/20 0.31
HSD17B10 Q99714 1/20 0.31
CASP3 P42574 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
SCHEMBL4716639 1.00 GAA (0.36) GAABRD4BRD2BRD3BRDT
SCHEMBL4714512 0.84 CHRM5 (0.43) HRH3CYP1A2SIGMAR1
SCHEMBL4718923 0.82 CHRM5 (0.46) HRH3CYP1A2SIGMAR1
SCHEMBL4715901 0.77 RAD52 (0.36) HRH3SMN1; SMN2SIGMAR1CASP3
SCHEMBL3078767 0.77 CYP1A2 (0.43) CYP1A2
SCHEMBL155970 0.77 CYP1A2 (0.43) CYP1A2
SCHEMBL18875532 0.74 ALDH1A1 (0.41) GAAHRH3ALDH1A1KDM4ESIGMAR1
SCHEMBL2385045 0.73 BRD4 (0.34) GAABRD4BRD2BRD3BRDT
SCHEMBL2385043 0.73 DPP4 (0.36) GAABRD4BRD2BRD3BRDT
SCHEMBL4714209 0.73 SIGMAR1 (0.49) GAAHRH3CYP1A2ALDH1A1SIGMAR1

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-1866293-A1 COMPOUNDS COMPRISING AN OXAZOLE OR THIAZOLE MOIETY, PROCESSES FOR MAKING THEM, AND THEIR USES UCB Pharma, S.A. (BE) 2007-12-19 EP disclosed
WO-2006103045-A1 COMPOUNDS COMPRISING AN OXAZOLE OR THIAZOLE MOIETY, PROCESSES FOR MAKING THEM, AND THEIR USES UCB PHARMA S.A. (BE) 2006-10-05 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-20080275046-A1 Compounds Comprising an Oxazole or Thiazole Moiety, Processes for Making Them, and Their Uses OXER1, OXTR, OGFR GAA 3115/4885BRD4 1177/4885BRD2 1909/4885

“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.