SCHEMBL3853352

SCHEMBL3853352

CCCCCc1c(-c2ccccc2)n(C)c2ccc(-c3ccc(O)cc3)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
HPGD P15428 3/20 0.49
HSD17B10 Q99714 2/20 0.49
PPARG P37231 2/20 0.48
KDM4E B2RXH2 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
HSD11B1 P28845 1/20 0.43
TBXAS1 P24557 1/20 0.43
ICMT O60725 2/20 0.43
ESR1 P03372 3/20 0.42
ESR2 Q92731 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
TACR1 P25103 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
SCHEMBL3852015 0.86 PPARG (0.48) ALDH1A1HPGDHSD17B10PPARGKDM4E
SCHEMBL3856331 0.84 PLA2G2A (0.49) ALDH1A1HPGDHSD17B10PPARGKDM4E
SCHEMBL3853394 0.83 PPARG (0.67) PPARGTBXAS1
SCHEMBL3854575 0.81 ALDH1A1 (0.49) ALDH1A1HPGDHSD17B10PPARGKDM4E
SCHEMBL3852354 0.81 PPARG (0.51) ALDH1A1HPGDHSD17B10PPARGKDM4E
SCHEMBL3857040 0.81 PPARG (0.46) ALDH1A1HPGDHSD17B10PPARGKDM4E
SCHEMBL3853361 0.81 PPARG (0.56) ALDH1A1HPGDPPARGKDM4ESMN1; SMN2
SCHEMBL3856953 0.79 ESR1 (0.52) ALDH1A1HPGDHSD17B10KDM4ESMN1; SMN2
SCHEMBL3854572 0.78 PPARG (0.42) ALDH1A1HPGDHSD17B10PPARGKDM4E
SCHEMBL3854596 0.73 KDM4E (0.45) ALDH1A1HPGDPPARGKDM4ESMN1; 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 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 ALDH1A1 423/4885HPGD 1848/4885HSD17B10 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.