SCHEMBL6819489

SCHEMBL6819489

O=C(O)c1cc(-c2ccccc2OCCCCCO)on1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.54
FAAH O00519 2/20 0.53
HPGD P15428 5/20 0.50
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 4/20 0.50
RAB9A P51151 3/20 0.50
KDM4E B2RXH2 2/20 0.50
NPSR1 Q6W5P4 1/20 0.49
NPC1 O15118 2/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALOX15 P16050 1/20 0.46
HIF1A Q16665 1/20 0.46

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
SCHEMBL6813643 0.89 CNR2 (0.68) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL6818455 0.88 CNR2 (0.69) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL6819488 0.86 CNR2 (0.53) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL92482 0.86 CNR2 (0.64) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL6815937 0.82 ALDH1A1 (0.59) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL6814520 0.82 PTPN1 (0.53) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL71318 0.81 BRD4 (0.67) HPGDALDH1A1HSD17B10RAB9AKDM4E
SCHEMBL6818570 0.81 CNR2 (0.53) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL6818569 0.79 L3MBTL1 (0.58) CNR2FAAHHPGDALDH1A1HSD17B10
SCHEMBL6818119 0.79 ALDH1A1 (0.49) CNR2FAAHHPGDALDH1A1HSD17B10

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 2 patents. 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
WO-2004018428-A1 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 CNR2 3495/4885FAAH 737/4885HPGD 1657/4885

“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.