SCHEMBL333553

SCHEMBL333553

CC(C)Oc1ccc(-n2c(-c3ccc(C(=O)O)cc3)c(C(=O)O)c3cc(Oc4ccc(Cl)cc4)ccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP14 P54578 2/20 0.45
KMT2A Q03164 3/20 0.43
MDM2 Q00987 7/20 0.42
BCL2 P10415 6/20 0.42
MCL1 Q07820 6/20 0.42
PTGES O14684 1/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
CHEK2 O96017 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PPARG P37231 1/20 0.38
MEN1 O00255 2/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL333886 0.92 RXRA (0.45) USP14KMT2AMDM2BCL2MCL1
SCHEMBL334015 0.92 KMT2A (0.43) USP14KMT2AMDM2BCL2MCL1
SCHEMBL27717578 0.91 USP14 (0.45) USP14KMT2ARXRARXRBCHEK2
SCHEMBL333544 0.88 PTGES (0.45) KMT2AMDM2BCL2MCL1PTGES
SCHEMBL333633 0.88 BCL2 (0.44) USP14KMT2AMDM2BCL2MCL1
SCHEMBL28767827 0.84 USP14 (0.43) USP14KMT2AKDM4EMEN1HPGD
SCHEMBL27697434 0.83 PTGER4 (0.44) USP14RXRARXRBKDM4EPPARG
SCHEMBL503872 0.81 USP14 (0.48) USP14KMT2APTGESKDM4EPPARG
SCHEMBL335545 0.80 MDM2 (0.44) USP14KMT2AMDM2BCL2MCL1
SCHEMBL334104 0.80 MDM2 (0.42) KMT2AMDM2BCL2MCL1PTGES

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-8097623-B2 1-Aryl-or heteroaryl-3-aryl-or heteroarylindole-2-carboxylic acids or esters: e.g., 5-(4-tert-Butylphenyl)-1,3-bis(4-isopropoxyphenyl)-indole-2-carboxylic acid; inhibition of the activity of microsomal prostaglandin E synthase-1, leukotriene C4 and/or 5-lipoxygenase-activating protein; analgesics BIOLIPOX AB (SE) 2012-01-17 US disclosed
EP-1841735-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2011-03-09 EP disclosed
US-20090076004-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-03-19 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-20090076004-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG USP14 3873/4885KMT2A 3484/4885MDM2 917/4885

“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.