SCHEMBL3087050

SCHEMBL3087050

COc1cc(-c2nc(CN3CCCCC3)co2)ccc1OCCCCl

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.57
ABCB1 P08183 5/20 0.50
ABCC1 P33527 3/20 0.50
DRD2 P14416 3/20 0.47
DRD4 P21917 3/20 0.47
DRD3 P35462 3/20 0.47
S1PR1 P21453 3/20 0.45
ADORA2A P29274 1/20 0.41
MCHR1 Q99705 1/20 0.41

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
SCHEMBL3065720 0.88 HRH3 (0.59) HRH3ABCB1ABCC1DRD2DRD4
SCHEMBL3070986 0.87 HRH3 (0.58) HRH3ABCB1ABCC1DRD2DRD4
SCHEMBL3085367 0.84 HRH3 (0.54) HRH3ABCB1ABCC1
SCHEMBL3071421 0.82 ABCB1 (0.55) HRH3ABCB1ABCC1DRD2DRD4
SCHEMBL3074570 0.79 HRH3 (0.55) HRH3ABCB1ABCC1DRD2DRD4
SCHEMBL3082257 0.78 HRH3 (0.70) HRH3ABCB1ABCC1DRD2DRD4
SCHEMBL3084148 0.77 HRH3 (0.55) HRH3ABCB1ABCC1DRD2DRD4
SCHEMBL5188047 0.75 ACP1 (0.43) ABCB1ABCC1
SCHEMBL3066616 0.75 HRH3 (0.55) HRH3
SCHEMBL2764403 0.74 DRD2 (0.49) HRH3ABCB1ABCC1DRD2DRD4

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 3 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-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

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 4/4885ABCB1 500/4885ABCC1 572/4885

“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.