SCHEMBL3852008

SCHEMBL3852008

COC(=O)COc1ccc(-c2ccc3c(c2)c(C)c(-c2ccccc2)n3Cc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 14/20 0.51
PLA2G2A P14555 1/20 0.48
GRIK2 Q13002 1/20 0.48
PTGES2 Q9H7Z7 3/20 0.47
PTGES O14684 1/20 0.47
FAAH O00519 1/20 0.46
ESR2 Q92731 2/20 0.46
MLNR O43193 1/20 0.46
ABCB11 O95342 1/20 0.46
NR3C1 P04150 1/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
CHRM1 P11229 1/20 0.46
DRD2 P14416 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
DRD1 P21728 1/20 0.46
SLC6A2 P23975 1/20 0.46

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
SCHEMBL3854951 0.92 ESR1 (0.46) ESR1PLA2G2AGRIK2FAAH
SCHEMBL3852991 0.91 PLA2G2A (0.54) ESR1PLA2G2AGRIK2PTGES2PTGES
SCHEMBL3852753 0.90 PLA2G2A (0.53) PLA2G2A
SCHEMBL3854601 0.88 PLA2G2A (0.49) PLA2G2AFAAH
SCHEMBL3854992 0.86 PLA2G2A (0.48) PLA2G2AFAAH
SCHEMBL6796561 0.86 ESR1 (0.51) ESR1GRIK2ESR2MLNRABCB11
SCHEMBL6795558 0.86 ESR1 (0.51) ESR1PLA2G2AESR2MLNRABCB11
SCHEMBL6802235 0.85 ESR1 (0.52) ESR1ESR2MLNRABCB11NR3C1
SCHEMBL6794385 0.84 ESR1 (0.53) ESR1ESR2MLNRABCB11NR3C1
SCHEMBL3855197 0.84 GRIK2 (0.64) ESR1PLA2G2AGRIK2

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 ESR1 1756/4885PLA2G2A 3821/4885GRIK2 545/4885

“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.