SCHEMBL5155346

SCHEMBL5155346

CC(C)(C)[Si](C)(C)Oc1cccc(C(=O)c2cc(Br)ccc2C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C2 P52895 3/20 0.44
AKR1C1 Q04828 3/20 0.44
CYP2C8 P10632 1/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 2/20 0.41
SORT1 Q99523 2/20 0.40
AKR1C3 P42330 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
CDC25A P30304 1/20 0.38
CDC25B P30305 1/20 0.38
HSD17B10 Q99714 1/20 0.38
AKR1C4 P17516 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL5156418 0.95 AKR1C2 (0.44) AKR1C2AKR1C1CYP2C8POLBMAPT
SCHEMBL5188852 0.87 MAPT (0.55) AKR1C2AKR1C1POLBMAPTKDM4E
SCHEMBL18529823 0.83 MAOB (0.43) MAPTNPC1RAB9ATDP1ALDH1A1
SCHEMBL4675271 0.82 CYP2C8 (0.59) AKR1C2AKR1C1CYP2C8POLBMAPT
SCHEMBL5173147 0.81 AKR1C2 (0.50) AKR1C2AKR1C1CYP2C8POLBMAPT
SCHEMBL30785086 0.81 STS (0.50) AKR1C3TDP1ALDH1A1
SCHEMBL2989104 0.80 AKR1C3 (0.53) POLBAKR1C3KDM4ENPC1RAB9A
SCHEMBL5914672 0.80 AKR1C2 (0.34) AKR1C2AKR1C1CYP2C8MAPTKDM4E
SCHEMBL18540693 0.80 STS (0.40) ALDH1A1
SCHEMBL4680433 0.77 CYP2C8 (0.59) AKR1C2AKR1C1CYP2C8POLBMAPT

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
EP-1740558-A1 BENZOXAZOCINES AND THEIR THERAPEUTIC USE AS MONOAMINE REUPTAKE INHIBITORS Sosei R&D Ltd. (GB) 2007-01-10 EP disclosed
US-20060019940-A1 Novel benzoxazocines and their therapeutic use SOSEI R&D LTD. (GB) 2006-01-26 US disclosed
WO-2005103019-A1 BENZOXAZOCINES AND THEIR THERAPEUTIC USE AS MONOAMINE REUPTAKE INHIBITORS SOSEI R&D LTD. (GB) 2005-11-03 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-20060019940-A1 Novel benzoxazocines and their therapeutic use HTR4, OPRM1, GRM4 AKR1C2 3666/4885AKR1C1 3194/4885CYP2C8 364/4885

“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.