SCHEMBL6501980

SCHEMBL6501980

CCN(CCCNC(=O)CCc1ccccc1)Cc1cccc(Oc2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.69
BCHE P06276 2/20 0.54
TSHR P16473 1/20 0.53
HSD17B10 Q99714 1/20 0.53
HPGD P15428 1/20 0.52
APP P05067 3/20 0.52
FDFT1 P37268 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
FFAR1 O14842 1/20 0.49
ACKR3 P25106 1/20 0.48

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
SCHEMBL6500610 0.94 GAA (0.59) GAABCHETSHRHSD17B10HPGD
SCHEMBL6508928 0.90 GAA (0.62) GAABCHEHPGDAPPKDM4E
SCHEMBL6506029 0.88 LMNA (0.55) GAABCHETSHRHSD17B10APP
SCHEMBL6507792 0.86 MTNR1A (0.51) GAATSHRHSD17B10APPKDM4E
SCHEMBL6496215 0.86 GAA (0.50) GAABCHETSHRHSD17B10APP
SCHEMBL6505559 0.84 EPHX2 (0.56) GAABCHETSHRHSD17B10APP
SCHEMBL6497288 0.83 TSHR (0.53) GAABCHETSHRHSD17B10APP
SCHEMBL6529392 0.83 TSHR (0.48) GAABCHETSHRHSD17B10APP
SCHEMBL6498185 0.83 TSHR (0.49) GAABCHETSHRHSD17B10HPGD
SCHEMBL6499395 0.82 BCHE (0.56) GAABCHETSHRHSD17B10APP

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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 GAA 2177/4885BCHE 945/4885TSHR 3179/4885

“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.