SCHEMBL6090174

SCHEMBL6090174

CCCCc1ccc(-c2ccc3c(NC(=O)c4cccc(-n5c(C)ccc5C)c4)c(C(=O)OCC)n(Cc4cccc(Cl)c4)c3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.41
PTGES O14684 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
ELANE P08246 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPK8 P45983 1/20 0.36
AGTR1 P30556 2/20 0.36
AGTR2 P50052 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
MAPT P10636 2/20 0.35
PTGER1 P34995 1/20 0.35
MAP1LC3B Q9GZQ8 1/20 0.35
MAP1LC3A Q9H492 1/20 0.35
POLB P06746 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
SCHEMBL6091171 0.93 KDM4E (0.39) TP53RXFP1KDM4EIRAK4PTGER1
SCHEMBL6093283 0.92 KDM4E (0.39) TP53RXFP1KDM4EIRAK4PTGER1
SCHEMBL6093287 0.92 KDM4E (0.37) TP53RXFP1KDM4EIRAK4MAPT
SCHEMBL6093291 0.92 KDM4E (0.39) RXFP1KDM4EIRAK4PTGER1
SCHEMBL6092716 0.89 TP53 (0.42) TP53PTGESRXFP1ELANEKDM4E
SCHEMBL5798590 0.87 L3MBTL1 (0.43) TP53IRAK4
SCHEMBL6092717 0.86 RXFP1 (0.40) TP53PTGESRXFP1MAPT
SCHEMBL6090346 0.84 MAPT (0.42) TP53RXFP1MAPTPOLB
SCHEMBL5738325 0.81 TP53 (0.46) TP53PTGESRXFP1MAPK8MAPT
SCHEMBL6091080 0.81 HDAC1 (0.42) TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060160879-A1 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-07-20 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 (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-20060160879-A1 Indoles useful in the treatment of inflammation IDO1, PTGS1, IDO2 TP53 2032/4885PTGES 4/4885RXFP1 106/4885

“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.