SCHEMBL3853519

SCHEMBL3853519

COC(=O)COc1ccc(-c2ccc3c(c2)c2c(n3Cc3ccccc3)CCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.52
FABP4 P15090 5/20 0.50
HSD17B10 Q99714 1/20 0.50
PTGDR2 Q9Y5Y4 2/20 0.47
HDAC6 Q9UBN7 3/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC10 Q969S8 1/20 0.47
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
PLA2G2A P14555 4/20 0.46
FABP3 P05413 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44

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
SCHEMBL3852363 0.90 FABP4 (0.53) HTR6FABP4HSD17B10PTGDR2HDAC6
SCHEMBL3859121 0.85 HTR6 (0.67) HTR6FABP4PTGDR2CA1CA2
SCHEMBL3852753 0.81 PLA2G2A (0.53) PLA2G2A
SCHEMBL3860461 0.81 HTR6 (0.50) HTR6FABP4HDAC6HDAC1HDAC10
SCHEMBL3852008 0.80 ESR1 (0.51) PLA2G2APTGS2
SCHEMBL3853296 0.79 CA1 (0.59) HTR6FABP4PTGDR2HDAC6HDAC1
SCHEMBL3855935 0.79 PLA2G2A (0.57) PLA2G2A
SCHEMBL3854601 0.78 PLA2G2A (0.49) PLA2G2A
SCHEMBL3853687 0.75 HTR6 (0.45) HTR6FABP4HDAC6HDAC1HDAC10
SCHEMBL3854992 0.75 PLA2G2A (0.48) PLA2G2A

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-7582773-B2 Substituted phenyl indoles WYETH (US) 2009-09-01 US disclosed
US-20050070592-A1 Substituted phenyl indoles WYETH (US) 2005-03-31 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-20050070592-A1 Substituted phenyl indoles TPH2, IDO2, AANAT HTR6 18/4885FABP4 3815/4885HSD17B10 2232/4885

“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.