SCHEMBL6098744

SCHEMBL6098744

COC(=O)C(=O)c1c[nH]c2ccc(OCc3ccccc3)cc12

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.57
HPGD P15428 1/20 0.57
MDH2 P40926 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
LTA4H P09960 5/20 0.55
PLA2G2A P14555 5/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
HSP90AA1 P07900 1/20 0.55
HSP90AB1 P08238 1/20 0.55
TRPM8 Q7Z2W7 3/20 0.55
KDM4E B2RXH2 1/20 0.53
MAPT P10636 1/20 0.53
HTR1D P28221 3/20 0.53
POLB P06746 2/20 0.53
SLC6A4 P31645 1/20 0.51
KIF20A O95235 1/20 0.50

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
SCHEMBL2084401 0.91 MDH2 (0.66) ALDH1A1HPGDMDH2SMN1; SMN2MEN1
SCHEMBL11620503 0.89 TRPM8 (0.61) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL9023222 0.88 NR4A2 (0.66) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL11602121 0.88 ALDH1A1 (0.61) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL11194622 0.86 ALDH1A1 (0.59) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL6764594 0.85 MAOB (0.61) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL7448403 0.85 HTR1D (0.57) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL5114492 0.85 POLB (0.59) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL14554210 0.84 MEN1 (0.60) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H
SCHEMBL28123392 0.83 TRPM8 (0.60) ALDH1A1HPGDMDH2SMN1; SMN2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7129250-B2 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2006-10-31 US disclosed
US-6867198-B2 Agents and methods for the treatment of proliferative diseases ELI LILLY AND COMPANY (US) 2005-03-15 US disclosed
US-20040220202-A1 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2004-11-04 US disclosed
US-6743785-B2 KINASE INHIBITORS; ANNULATED PYRROLE AND INDOLE RINGS; PYRROLO (3,2,1-HI)INDOLES; 3-(5,5-DIMETHYL-5,6-DIHYDRO-4H-PYRROLO (3,2,1-IJ)QUINOLIN-1-YL)-4-(1,2,3,4-TETRAHYDRO-(1,4) DIAZEPINO(6,7,1-HI)INDOL-7-YL)-PYRROLE-2,5-DIONE ELI LILLY AND COMPANY 2004-06-01 US disclosed
US-20040102467-A1 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2004-05-27 US disclosed
EP-1250334-B1 Medicaments useful for the treatment of proliferative diseases LILLY CO ELI (US) 2004-05-19 EP disclosed
US-20030229026-A1 Agents and methods for the treatment of proliferative diseases ELI LILLY AND COMPANY 2003-12-11 US disclosed
US-20030092676-A1 Agents and method for the treatment of proliferative diseases ELI LILLY AND COMPANY 2003-05-15 US disclosed
EP-1283836-A2 NEUROPROTECTIVE AND ANTI-PROLIFERATIVE COMPOUNDS Aegera Therapeutics Inc. (CA) 2003-02-19 EP disclosed
EP-1250334-A2 AGENTS AND METHODS FOR THE TREATMENT OF PROLIFERATIVE DISEASES ELI LILLY AND COMPANY (US) 2002-10-23 EP disclosed
EP-1242420-A2 AGENTS AND METHODS FOR THE TREATMENT OF PROLIFERATIVE DISEASES ELI LILLY AND COMPANY (US) 2002-09-25 EP disclosed
WO-2001087887-A2 NEUROPROTECTIVE AND ANTI-PROLIFERATIVE COMPOUNDS AEGERA THERAPEUTICS INC. (CA) 2001-11-22 WO disclosed
WO-2001044235-A2 AGENTS AND METHODS FOR THE TREATMENT OF PROLIFERATIVE DISEASES ELI LILLY AND COMPANY (US) 2001-06-21 WO disclosed
WO-2001044247-A2 AGENTS AND METHODS FOR THE TREATMENT OF PROLIFERATIVE DISEASES ELI LILLY AND COMPANY (US) 2001-06-21 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 (4 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-20030092676-A1 Agents and method for the treatment of proliferative diseases MKI67, CDKN1A, CDK4 ALDH1A1 1225/4885HPGD 1210/4885MDH2 1344/4885
US-20040220202-A1 Neuroprotective and anti-proliferative compounds NLN, MKI67, BDNF ALDH1A1 892/4885HPGD 475/4885MDH2 494/4885
US-20040102467-A1 Neuroprotective and anti-proliferative compounds MKI67, NLN, BDNF ALDH1A1 746/4885HPGD 405/4885MDH2 453/4885
US-20030229026-A1 Agents and methods for the treatment of proliferative diseases MKI67, CDKN1A, CDK1 ALDH1A1 1132/4885HPGD 1187/4885MDH2 1438/4885

“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.