SCHEMBL503499

SCHEMBL503499

CC(C)Oc1ccc(Oc2ccc3c(c2)c(C(=O)O)c(CC(=O)O)n3-c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 3/20 0.45
MCL1 Q07820 3/20 0.44
EDNRA P25101 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PLA2G4A P47712 1/20 0.42
KDM4E B2RXH2 1/20 0.41
AGTR1 P30556 1/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 2/20 0.41
USP14 P54578 1/20 0.40
EDNRB P24530 1/20 0.40
PTGDR Q13258 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
LTB4R Q15722 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
BCL2 P10415 1/20 0.39
FFAR1 O14842 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
SCHEMBL503871 0.93 MEN1 (0.48) MDM2EDNRAMEN1KMT2AKDM4E
SCHEMBL503475 0.93 KMT2A (0.43) MDM2MCL1MEN1KMT2APLA2G4A
SCHEMBL503554 0.93 MEN1 (0.45) MDM2MEN1KMT2AUSP14FFAR1
SCHEMBL503625 0.92 USP14 (0.44) MDM2MEN1KMT2ALMNAMAPT
SCHEMBL503558 0.90 MEN1 (0.44) MDM2MEN1KMT2APLA2G4AKDM4E
SCHEMBL504142 0.90 MEN1 (0.44) MDM2MEN1KMT2AMAPTUSP14
SCHEMBL503599 0.90 MAOB (0.40) MDM2MCL1MEN1KMT2AKDM4E
SCHEMBL503612 0.88 NPC1 (0.41) MDM2MCL1EDNRAMEN1KMT2A
SCHEMBL333231 0.88 MEN1 (0.48) MEN1KMT2AKDM4EMAPTUSP14
SCHEMBL503844 0.88 MAOB (0.41) MDM2MCL1MEN1KMT2APLA2G4A

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 MDM2 1738/4885MCL1 1760/4885EDNRA 76/4885

“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.