SCHEMBL503844

SCHEMBL503844

CC(C)Oc1ccc(Oc2ccc3c(c2)c(C(=O)O)c(CC(=O)O)n3-c2ccc(OCc3ccccc3C(F)(F)F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
ADAMTS4 O75173 1/20 0.39
MMP13 P45452 1/20 0.39
PPARA Q07869 3/20 0.38
PPARG P37231 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 2/20 0.36
MDM2 Q00987 2/20 0.36
PLA2G4A P47712 1/20 0.36
USP14 P54578 1/20 0.36
PPARD Q03181 3/20 0.35
LNPEP Q9UIQ6 1/20 0.35
PLK1 P53350 1/20 0.35
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
BCL2 P10415 1/20 0.35
MCL1 Q07820 1/20 0.35

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
SCHEMBL503558 0.88 MEN1 (0.44) MAOBMAOAMEN1KMT2AKDM4E
SCHEMBL503499 0.88 MDM2 (0.45) PPARAMEN1KMT2AKDM4EMAPT
SCHEMBL334349 0.85 PPARG (0.44) PPARAPPARGMEN1KMT2APPARD
SCHEMBL504356 0.83 PPARG (0.42) PPARAPPARGMEN1KMT2AKDM4E
SCHEMBL361319 0.83 PPARG (0.42) PPARAPPARGMEN1KMT2AKDM4E
SCHEMBL503599 0.83 MAOB (0.40) MAOBADAMTS4MEN1KMT2AKDM4E
SCHEMBL503871 0.83 MEN1 (0.48) PPARAPPARGMEN1KMT2AKDM4E
SCHEMBL503475 0.83 KMT2A (0.43) PPARAPPARGMEN1KMT2AKDM4E
SCHEMBL333817 0.83 PPARG (0.52) PPARAPPARG
SCHEMBL503625 0.82 USP14 (0.44) MAOBMAOAPPARAPPARGMEN1

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-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 MAOB 85/4885MAOA 47/4885ADAMTS4 1975/4885

“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.