SCHEMBL6859385

SCHEMBL6859385

CCOC(=O)c1[nH]c2ccccc2c1Cc1ccc(OC)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.61
HPGD P15428 2/20 0.60
KMT2A Q03164 2/20 0.60
LMNA P02545 2/20 0.60
HTT P42858 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
HTR1A P08908 1/20 0.59
DRD2 P14416 1/20 0.59
DRD4 P21917 1/20 0.59
HTR1D P28221 1/20 0.59
HTR1B P28222 1/20 0.59
HTR1F P30939 1/20 0.59
HTR7 P34969 1/20 0.59
DRD3 P35462 1/20 0.59
KDM4E B2RXH2 5/20 0.56
MAPT P10636 4/20 0.56
ALDH1A1 P00352 3/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
TUBB4A P04350 4/20 0.54

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
SCHEMBL7671532 0.89 HTR6 (0.68) HTR6HPGDHTR1ADRD2DRD4
SCHEMBL31744875 0.87 HTR6 (0.62) HTR6HPGDLMNASMN1; SMN2HTR1A
SCHEMBL7005362 0.84 MAPT (0.48) HTR6HPGDKMT2ALMNAHTT
SCHEMBL7521371 0.81 HTR6 (0.53) HTR6HPGDKMT2ALMNAHTT
SCHEMBL3029129 0.81 HTR6 (0.75) HTR6HPGDKMT2ASMN1; SMN2HTR1A
SCHEMBL6857725 0.81 HPGD (0.62) HTR6HPGDKMT2ALMNAHTT
SCHEMBL13485649 0.80 HTR6 (0.67) HTR6HPGDKMT2ALMNAHTT
SCHEMBL2885143 0.80 HPGD (0.61) HTR6HPGDKMT2ALMNAHTT
SCHEMBL3195026 0.79 HTR6 (0.73) HTR6HPGDKMT2ASMN1; SMN2HTR1A
SCHEMBL7526435 0.79 HTR6 (0.58) HTR6HPGDLMNAHTR1ADRD2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101711235-A 7-unsubstituted indole MCL-1 inhibitors ABBOTT LAB 2010-05-19 CN disclosed
US-6787651-B2 2-CARBOXY-SUBSTITUTED; TREATING OSTEOPENIA, OSTEOPOROSIS, CANCER, DIABETES AND ATHEROSCLEROSIS. SMITHKLINE BEECHAM CORPORATION 2004-09-07 US disclosed
EP-1341761-A1 SUBSTITUTED INDOLES, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH INDOLES AND THEIR USE AS PPAR-$g(g) BINDING AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-10 EP disclosed
US-20030087902-A1 Substituted indoles, pharmaceutical compounds containing such indoles and their use as PPAR-gamma binding agents SMITHKLINE BEECHAM CORPORATION 2003-05-08 US disclosed
WO-2002030895-A1 SUBSTITUTED INDOLES, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH INDOLES AND THEIR USE AS PPAR-η BINDING AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-18 WO 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-20030087902-A1 Substituted indoles, pharmaceutical compounds containing such indoles and their use as PPAR-gamma binding agents PPARG, PPARA, PPARD HTR6 73/4885HPGD 442/4885KMT2A 2753/4885

“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.