SCHEMBL6814848

SCHEMBL6814848

O=C(O)c1cc(-c2ccccc2OCC2C=CCCC2)on1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.47
FAAH O00519 2/20 0.46
NPC1 O15118 6/20 0.44
RAB9A P51151 6/20 0.44
ALDH1A1 P00352 6/20 0.41
HPGD P15428 5/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
KDM4E B2RXH2 2/20 0.41
HSD17B10 Q99714 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 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
SCHEMBL6819515 0.87 CNR2 (0.48) CNR2FAAHNPC1RAB9AALDH1A1
SCHEMBL6818630 0.82 CNR2 (0.54) CNR2FAAHNPC1RAB9AALDH1A1
SCHEMBL6818945 0.82 CNR2 (0.42) CNR2FAAHNPC1RAB9AALDH1A1
SCHEMBL6813941 0.79 CNR2 (0.53) CNR2FAAHNPC1RAB9AHPGD
SCHEMBL6819033 0.79 NPC1 (0.52) CNR2FAAHNPC1RAB9AALDH1A1
SCHEMBL6819675 0.75 CNR2 (0.58) CNR2FAAHNPC1RAB9AALDH1A1
SCHEMBL6814520 0.75 PTPN1 (0.53) CNR2FAAHNPC1RAB9AALDH1A1
SCHEMBL6815937 0.75 ALDH1A1 (0.59) CNR2FAAHNPC1RAB9AALDH1A1
SCHEMBL71318 0.74 BRD4 (0.67) NPC1RAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL6834473 0.73 L3MBTL1 (0.45) CNR2FAAHNPC1RAB9AALDH1A1

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 737/4885NPC1 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.