SCHEMBL18151306

SCHEMBL18151306

CCOC(=O)CC(CC(=O)O)c1ccccc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
HTT P42858 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
CTSA P10619 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GLA P06280 1/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.43
PLIN1 O60240 1/20 0.43
MAPT P10636 1/20 0.43
PLIN5 Q00G26 1/20 0.43
KMT2A Q03164 1/20 0.43
ABHD5 Q8WTS1 1/20 0.43
F2 P00734 1/20 0.42
PTGFR P43088 3/20 0.41
IDO1 P14902 1/20 0.41
TDO2 P48775 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
SCHEMBL18150761 0.88 POLB (0.73) POLBL3MBTL1HTTNPSR1CTSA
SCHEMBL30781902 0.88 POLB (0.73) POLBL3MBTL1HTTNPSR1CTSA
SCHEMBL18151385 0.87 POLB (0.63) POLBL3MBTL1HTTNPSR1CTSA
SCHEMBL27544216 0.85 ALDH1A1 (0.47) POLBL3MBTL1HTTNPSR1ALDH1A1
SCHEMBL15969857 0.84 POLB (0.50) POLBL3MBTL1HTTNPSR1ALDH1A1
SCHEMBL15969801 0.83 POLB (0.49) POLBL3MBTL1HTTNPSR1ALDH1A1
SCHEMBL17755320 0.83 POLB (0.62) POLBL3MBTL1HTTNPSR1ALDH1A1
SCHEMBL14576778 0.83 POLB (0.62) POLBL3MBTL1HTTNPSR1ALDH1A1
SCHEMBL23802039 0.83 PTGFR (0.43) POLBL3MBTL1HTTNPSR1PTGFR
SCHEMBL15968923 0.81 POLB (0.48) POLBL3MBTL1HTTNPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10266532-B2 Tricyclic modulators of TNF signaling ABBVIE INC. (US) 2019-04-23 US disclosed
US-20180179198-A1 TRICYCLIC MODULATORS OF TNF SIGNALING ABBVIE INC. 2018-06-28 US disclosed
US-20180179198-A1 TRICYCLIC MODULATORS OF TNF SIGNALING ABBVIE INC. 2018-06-28 US disclosed
EP-3288939-A1 TRICYCLIC MODULATORS OF TNF SIGNALING AbbVie Inc. (US) 2018-03-07 EP disclosed
US-9856253-B2 Tricyclic modulators of TNF signaling ABBVIE, INC. (US) 2018-01-02 US disclosed
US-9856253-B2 Tricyclic modulators of TNF signaling ABBVIE, INC. (US) 2018-01-02 US disclosed
US-20160304517-A1 TRICYCLIC MODULATORS OF TNF SIGNALING ABBVIE INC. 2016-10-20 US disclosed
US-20160304517-A1 TRICYCLIC MODULATORS OF TNF SIGNALING ABBVIE INC. 2016-10-20 US disclosed
WO-2016168641-A1 TRICYCLIC MODULATORS OF TNF SIGNALING ABBVIE INC. (US) 2016-10-20 WO disclosed
WO-2016168641-A1 TRICYCLIC MODULATORS OF TNF SIGNALING ABBVIE INC. (US) 2016-10-20 WO disclosed
US-20160304517-A1 TRICYCLIC MODULATORS OF TNF SIGNALING ABBVIE INC. 2016-10-20 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 (3 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-20160304517-A1 TRICYCLIC MODULATORS OF TNF SIGNALING TNF, TNFRSF1A, CD40 POLB 3462/4885L3MBTL1 4129/4885HTT 2609/4885
US-10266532-B2 Tricyclic modulators of TNF signaling TNF, TNFRSF1A, CD40 POLB 3462/4885L3MBTL1 4129/4885HTT 2609/4885
US-20180179198-A1 TRICYCLIC MODULATORS OF TNF SIGNALING TNF, TNFRSF1A, CD40 POLB 3462/4885L3MBTL1 4129/4885HTT 2609/4885

“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.