SCHEMBL4857396

SCHEMBL4857396

COc1ccc2[nH]c(CCOc3ccc(CC4SC(=O)NC4=O)cc3)cc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.56
MPC2 O95563 1/20 0.56
CYP2C8 P10632 1/20 0.56
CYP2C9 P11712 1/20 0.56
FFAR1 O14842 7/20 0.53
CYP3A4 P08684 2/20 0.52
RXRA P19793 1/20 0.52
CA2 P00918 1/20 0.50
PPARA Q07869 3/20 0.49
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 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
SCHEMBL1016492 0.87 PPARG (0.57) PPARGFFAR1CYP3A4RXRAPPARA
SCHEMBL6931816 0.81 FFAR1 (0.66) PPARGMPC2CYP2C8CYP2C9FFAR1
SCHEMBL6931105 0.80 PPARG (0.70) PPARGMPC2CYP2C8CYP2C9FFAR1
SCHEMBL4857392 0.79 PPARG (0.52) PPARGMPC2CYP2C8CYP2C9FFAR1
SCHEMBL14197265 0.79 PPARG (0.56) PPARGMPC2CYP2C8CYP2C9FFAR1
SCHEMBL13846731 0.79 CA2 (0.64) PPARGMPC2CYP2C8CYP2C9FFAR1
SCHEMBL8981939 0.78 KDM4E (0.66) PPARGMPC2CYP2C8CYP2C9CA2
SCHEMBL8981935 0.78 KDM4E (0.66) PPARGMPC2CYP2C8CYP2C9CA2
SCHEMBL8981926 0.78 KDM4E (0.66) PPARGMPC2CYP2C8CYP2C9CA2
SCHEMBL13846771 0.78 CA2 (0.63) PPARGMPC2CYP2C8CYP2C9CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050159463-A1 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2005-07-21 US claimed
EP-1189583-B1 INDOLE DERIVATIVES NEURIM PHARMA 1991 (IL) 2005-07-20 EP claimed
EP-1189583-A4 INDOLE DERIVATIVES NEURIM PHARMA 1991 (IL) 2004-04-14 EP claimed
EP-1189583-A1 INDOLE DERIVATIVES NEURIM PHARMACEUTICALS (1991) LIMITED (IL) 2002-03-27 EP claimed
WO-2000072815-A1 INDOLE DERIVATIVES NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2000-12-07 WO claimed
US-7355054-B2 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2008-04-08 US disclosed
US-20050159463-A1 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2005-07-21 US disclosed
EP-1189583-B1 INDOLE DERIVATIVES NEURIM PHARMA 1991 (IL) 2005-07-20 EP disclosed
US-6858642-B1 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2005-02-22 US disclosed
EP-1189583-A4 INDOLE DERIVATIVES NEURIM PHARMA 1991 (IL) 2004-04-14 EP disclosed
EP-1189583-A1 INDOLE DERIVATIVES NEURIM PHARMACEUTICALS (1991) LIMITED (IL) 2002-03-27 EP disclosed
WO-2000072815-A1 INDOLE DERIVATIVES NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2000-12-07 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-20050159463-A1 Indole derivatives IDO1, IDO2, H1-0 PPARG 2410/4885MPC2 3825/4885CYP2C8 551/4885

“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.