SCHEMBL6093040

SCHEMBL6093040

CC(C)(C)c1ccc(-c2ccc3c(NC(=O)c4ccc(Cl)cc4)c(C(=O)O)n(Cc4cccc(Cl)c4)c3c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 3/20 0.45
CCR9 P51686 2/20 0.44
SLC2A1 P11166 1/20 0.43
PLA2G2A P14555 1/20 0.42
P2RY14 Q15391 1/20 0.41
ABCB1 P08183 1/20 0.41
CNR1 P21554 1/20 0.41
PTGES2 Q9H7Z7 4/20 0.41
PPARG P37231 3/20 0.41
NR1H4 Q96RI1 3/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PTGES O14684 2/20 0.40

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
SCHEMBL5749488 0.92 PTGER4 (0.46) SERPINE1SLC2A1PLA2G2AP2RY14ABCB1
SCHEMBL6092260 0.92 SERPINE1 (0.43) SERPINE1CCR9SLC2A1PLA2G2AP2RY14
SCHEMBL6091451 0.91 SLC2A1 (0.44) SLC2A1PLA2G2AP2RY14ABCB1PPARG
SCHEMBL6091652 0.90 SERPINE1 (0.54) SERPINE1CCR9PLA2G2AP2RY14PTGES2
SCHEMBL5748986 0.90 PTGER4 (0.42) SLC2A1PLA2G2AP2RY14ABCB1PTGES2
SCHEMBL6093678 0.89 TP53 (0.41) SLC2A1PLA2G2AP2RY14ABCB1PPARG
SCHEMBL5738359 0.88 ADORA3 (0.46) SERPINE1SLC2A1PLA2G2AP2RY14ABCB1
SCHEMBL6091083 0.88 SMN1; SMN2 (0.44) SLC2A1PLA2G2AP2RY14ABCB1SMN1; SMN2
SCHEMBL6091080 0.87 HDAC1 (0.42) SLC2A1P2RY14ABCB1PPARG
SCHEMBL6091904 0.87 CCR2 (0.44) SLC2A1P2RY14ABCB1SMN1; SMN2

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 SERPINE1 508/4885CCR9 1123/4885SLC2A1 2589/4885

“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.