SCHEMBL4599514

SCHEMBL4599514

COC(=O)c1[nH]c2cc(OC)c(OC)cc2c1-c1ccc(OC)c(OC)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.51
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 7/20 0.51
HPGD P15428 7/20 0.51
GAA P10253 4/20 0.51
NPSR1 Q6W5P4 4/20 0.51
HTT P42858 2/20 0.51
PPARG P37231 1/20 0.51
NCOA2 Q15596 1/20 0.51
NCOA1 Q15788 1/20 0.51
USP2 O75604 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
TUBB4A P04350 2/20 0.48
TUBB P07437 2/20 0.48
TUBA3C P0DPH7 2/20 0.48
TUBA1B P68363 2/20 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
SCHEMBL9438013 0.88 MAPT (0.48) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL4592690 0.88 ALDH1A1 (0.53) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL5157162 0.88 MAPT (0.54) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL4592128 0.88 GPR35 (0.50) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL9437968 0.87 TUBB4A (0.65) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL9438074 0.87 TUBB4A (0.45) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL4599752 0.87 GPR35 (0.52) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL4592062 0.87 KDM4E (0.49) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL9437995 0.87 NPC1 (0.43) MAPTKDM4EALDH1A1HPGDGAA
SCHEMBL5161760 0.86 ALDH1A1 (0.60) MAPTKDM4EALDH1A1HPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1945305-A2 INDOLE AND AZAINDOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES BRANE DISCOVERY S.R.L. (IT) 2008-07-23 EP claimed
WO-2007048847-A2 INDOLE AND AZAINDOLE DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES NIKEM RESEARCH S.R.L. (IT) 2007-05-03 WO claimed
US-5296499-A Osteoporosis TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-22 US claimed
EP-0449196-A2 Indole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-10-02 EP claimed
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 US disclosed
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 US disclosed
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 US disclosed
EP-1750687-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2007-02-14 EP disclosed
WO-2005105213-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2005-11-10 WO disclosed
US-5296499-A Osteoporosis TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-22 US disclosed
EP-0449196-A2 Indole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-10-02 EP 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-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action IDO1, IDO2, INMT MAPT 4170/4885KDM4E 512/4885ALDH1A1 788/4885

“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.