SCHEMBL6834082

SCHEMBL6834082

CCOC(=O)c1cc(-c2ccccc2O[C@H]2CCC[C@H]2C)on1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.48
RAB9A P51151 6/20 0.46
NPC1 O15118 5/20 0.46
MAPT P10636 3/20 0.46
THRB P10828 1/20 0.46
FAAH O00519 2/20 0.46
ALDH1A1 P00352 5/20 0.44
HPGD P15428 4/20 0.44
HSD17B10 Q99714 2/20 0.44
ALOX15 P16050 1/20 0.44
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ACR P10323 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
SCHEMBL6819585 0.87 CNR2 (0.52) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL6833874 0.86 RAB9A (0.50) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL6818402 0.81 RAB9A (0.48) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL6817788 0.81 CNR2 (0.55) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL6819417 0.80 MAPT (0.46) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL22619918 0.79 RAB9A (0.67) RAB9ANPC1MAPTTHRBALDH1A1
SCHEMBL6818513 0.79 MAPT (0.54) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL6818861 0.78 CNR2 (0.52) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL6818863 0.77 CNR2 (0.59) CNR2RAB9ANPC1MAPTTHRB
SCHEMBL6817480 0.76 CNR2 (0.54) CNR2RAB9ANPC1MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 CNR2 3495/4885RAB9A 4337/4885NPC1 3778/4885

“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.