SCHEMBL3079159

SCHEMBL3079159

Oc1ccc(-c2nc(CN3CCCCC3)co2)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.54
DRD2 P14416 4/20 0.50
DRD4 P21917 3/20 0.50
DRD3 P35462 3/20 0.50
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ABCB1 P08183 5/20 0.43
HTR2A P28223 1/20 0.42
HRH1 P35367 1/20 0.42
ABCC1 P33527 3/20 0.40
TSHR P16473 1/20 0.40
GFER P55789 1/20 0.40
RCE1 Q9Y256 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 0.39
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL3072333 0.85 HRH3 (0.54) HRH3DRD2DRD4DRD3KDM4E
SCHEMBL3071421 0.82 ABCB1 (0.55) HRH3DRD2DRD4DRD3KDM4E
SCHEMBL3065720 0.80 HRH3 (0.59) HRH3DRD2DRD4DRD3HPGD
SCHEMBL3070233 0.77 DRD2 (0.56) HRH3DRD2DRD4DRD3ABCB1
SCHEMBL3066625 0.76 HRH3 (0.51) HRH3DRD2DRD4DRD3KDM4E
SCHEMBL3584279 0.75 HRH3 (0.62) HRH3DRD2DRD4DRD3ABCB1
Hydrochloric Acid SCHEMBL3592184 0.74 HRH3 (0.60) HRH3DRD2DRD4DRD3ABCB1
SCHEMBL3070986 0.72 HRH3 (0.58) HRH3DRD2DRD4DRD3KDM4E
SCHEMBL3066616 0.72 HRH3 (0.55) HRH3KDM4EHRH1
SCHEMBL3087050 0.71 HRH3 (0.57) HRH3DRD2DRD4DRD3ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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-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-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
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
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 HRH3 4/4885DRD2 930/4885DRD4 863/4885

“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.