SCHEMBL3202333

SCHEMBL3202333

CCOC(=O)C(Cc1ccccc1)NC(=O)c1ccc(Cn2ccc3cc(N)ccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.49
RAB9A P51151 2/20 0.48
GAA P10253 1/20 0.48
HDAC6 Q9UBN7 6/20 0.46
HDAC8 Q9BY41 5/20 0.46
HDAC1 Q13547 5/20 0.46
HDAC2 Q92769 5/20 0.46
HDAC3 O15379 4/20 0.46
HDAC11 Q96DB2 1/20 0.45
HDAC10 Q969S8 3/20 0.44
HDAC9 Q9UKV0 1/20 0.44
ACE P12821 1/20 0.44
CTSL P07711 1/20 0.44
TP53 P04637 1/20 0.44
NPC1 O15118 1/20 0.43
NTSR1 P30989 1/20 0.43

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
SCHEMBL3202345 1.00 PPARG (0.49) PPARGRAB9AGAAHDAC6HDAC8
SCHEMBL3197128 0.86 PPARG (0.53) PPARGRAB9AGAAHDAC6HDAC8
SCHEMBL7607209 0.79 CTSL (0.60) PPARGRAB9AGAAACECTSL
SCHEMBL3935801 0.79 CTSL (0.60) PPARGRAB9AGAAACECTSL
SCHEMBL3927028 0.76 CTSL (0.71) PPARGRAB9AGAAACECTSL
SCHEMBL28790851 0.76 CTSL (0.71) PPARGRAB9AGAAACECTSL
SCHEMBL31156814 0.75 GAA (0.65) PPARGRAB9AGAAACECTSL
SCHEMBL30241534 0.73 HTR6 (0.66) HDAC6HDAC8HDAC1HDAC2HDAC3
SCHEMBL2769024 0.73 HTR6 (0.66) HDAC6HDAC8HDAC1HDAC2HDAC3
SCHEMBL3193347 0.73 CA2 (0.49) PPARGNTSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137363-A1 Substituted Indoles And Methods Of Their Use WYETH LLC (US) 2010-06-03 US disclosed
US-7683091-B2 Substituted indoles and methods of their use WYETH (US) 2010-03-23 US disclosed
CN-101263115-A Substituted indoles and use thereof WYETH CORP (US) 2008-09-10 CN disclosed
EP-1919866-A2 SUBSTITUTED INDOLES AND USE THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-05-14 EP disclosed
US-20070043101-A1 Substituted indoles and methods of their use WYETH (US) 2007-02-22 US disclosed
WO-2007022321-A2 SUBSTITUTED INDOLES AND USE THEREOF WYETH (US) 2007-02-22 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 (2 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-20070043101-A1 Substituted indoles and methods of their use INMT, AANAT, IDO2 PPARG 3579/4885RAB9A 3251/4885GAA 3470/4885
US-20100137363-A1 Substituted Indoles And Methods Of Their Use INMT, AANAT, IDO2 PPARG 3579/4885RAB9A 3251/4885GAA 3470/4885

“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.