SCHEMBL3208073

SCHEMBL3208073

COc1cccc(Cl)c1Cc1cc2cnccc2nc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.39
TLR8 Q9NR97 1/20 0.37
HSP90AA1 P07900 3/20 0.37
HSP90AB1 P08238 2/20 0.37
ALDH1A1 P00352 1/20 0.36
PLA2G1B P04054 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
MC4R P32245 1/20 0.35
NQO2 P16083 1/20 0.35
EGFR P00533 1/20 0.34
DHFR P00374 1/20 0.34
HTT P42858 1/20 0.34
PDE5A O76074 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34

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
SCHEMBL3215144 0.92 PDE10A (0.42) PDE10ATLR8EGFRDHFRHTT
SCHEMBL3209362 0.86 PDE10A (0.39) PDE10ATLR8ALDH1A1MAPTL3MBTL1
SCHEMBL3217299 0.86 TLR8 (0.54) PDE10ATLR8HSP90AA1HSP90AB1NQO2
SCHEMBL3214919 0.84 TLR8 (0.44) PDE10ATLR8POLBDHFRPDE5A
SCHEMBL3219243 0.82 TLR8 (0.41) PDE10ATLR8MAPTDHFRHTT
SCHEMBL3218775 0.81 MAPT (0.41) TLR8HSP90AA1HSP90AB1ALDH1A1POLB
SCHEMBL3203933 0.81 AKT1 (0.40) TLR8HSP90AA1HSP90AB1ALDH1A1PLA2G1B
SCHEMBL4718249 0.80 PDE10A (0.42) PDE10AHSP90AA1HSP90AB1ALDH1A1MAPT
SCHEMBL3210074 0.77 TLR8 (0.41) TLR8HSP90AA1HSP90AB1ALDH1A1POLB
SCHEMBL3218819 0.77 NQO2 (0.42) TLR8HSP90AA1HSP90AB1POLBNQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221371-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS AbbVie Deutschland GmbH & Co. KG (DE) 2014-08-07 US disclosed
US-20100041698-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2010-02-18 US disclosed
EP-1917245-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS Abbott GmbH & Co. KG (DE) 2008-05-07 EP disclosed
WO-2007022946-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBOTT GMBH & CO. KG (DE) 2007-03-01 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-20140221371-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS HTR5A, HTR1A, HTR2C PDE10A 1050/4885TLR8 3013/4885HSP90AA1 2818/4885
US-20100041698-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS HTR5A, HTR1A, HTR2C PDE10A 1050/4885TLR8 3013/4885HSP90AA1 2818/4885

“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.