SCHEMBL503872

SCHEMBL503872

CC(C)Oc1ccc(Oc2ccc3c(c2)c(C(=O)O)c(CC(=O)O)n3-c2ccc(Oc3ccc(Cl)cc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP14 P54578 2/20 0.48
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
KDM4E B2RXH2 3/20 0.40
PTGDR2 Q9Y5Y4 6/20 0.40
PTGES O14684 3/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 2/20 0.39
MAPT P10636 2/20 0.39
CYP2C9 P11712 2/20 0.39
PMP22 Q01453 2/20 0.39
HIF1A Q16665 2/20 0.39
ABCC3 O15438 1/20 0.39
ABCC4 O15439 1/20 0.39
ABCB11 O95342 1/20 0.39
MT-CO2 P00403 1/20 0.39
ALB P02768 1/20 0.39
ABCB1 P08183 1/20 0.39
ALOX5 P09917 1/20 0.39
ADORA3 P0DMS8 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
SCHEMBL503625 0.94 USP14 (0.44) USP14KMT2AMEN1PTGESLMNA
SCHEMBL503756 0.93 USP14 (0.45) USP14KMT2AMEN1KDM4EPTGDR2
SCHEMBL334235 0.92 BCL2 (0.42) USP14KMT2AMEN1KDM4EPTGES
SCHEMBL333497 0.92 USP14 (0.44) USP14KMT2AMEN1KDM4EPTGDR2
SCHEMBL333231 0.91 MEN1 (0.48) USP14KMT2AMEN1KDM4EPTGDR2
SCHEMBL333959 0.91 USP14 (0.49) USP14KMT2AMEN1KDM4EPTGDR2
SCHEMBL335371 0.90 USP14 (0.41) USP14KDM4EPTGDR2PTGESMAPT
SCHEMBL503414 0.89 USP14 (0.42) USP14KMT2AMEN1KDM4EMAPT
SCHEMBL334350 0.89 PTGES (0.52) KMT2AMEN1KDM4EPTGESPPARG
SCHEMBL334162 0.88 USP14 (0.52) USP14KMT2AMEN1KDM4EPTGDR2

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
US-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 US disclosed
US-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 US disclosed
US-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 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-20120029016-A1 Indoles Useful in the Treatment of Inflammation LTC4S, LTB4R2, LTB4R USP14 2929/4885KMT2A 1783/4885MEN1 2934/4885

“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.