SCHEMBL1666044

SCHEMBL1666044

COc1cccc(-c2cn(Cc3ccccc3OC)c(N)n2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.61
LMNA P02545 7/20 0.52
CYP1A2 P05177 6/20 0.52
CYP3A4 P08684 6/20 0.52
CYP2D6 P10635 6/20 0.52
CYP2C19 P33261 6/20 0.52
TSHR P16473 5/20 0.52
CLK4 Q9HAZ1 4/20 0.52
CYP2C9 P11712 4/20 0.47
MAPK1 P28482 3/20 0.47
USP2 O75604 2/20 0.47
ALOX15 P16050 2/20 0.47
ADORA2A P29274 2/20 0.47
ADORA1 P30542 2/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HIF1A Q16665 1/20 0.46
DBH P09172 1/20 0.43
ALDH1A1 P00352 3/20 0.43
SLC16A3 O15427 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
SCHEMBL1666376 0.89 TLR8 (0.48) TLR8LMNACYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL1666047 0.87 TLR8 (0.54) TLR8MAPK1MEN1KMT2ADBH
Hydrochloric Acid SCHEMBL1665754 0.86 TLR8 (0.48) TLR8MEN1KMT2ADBH
SCHEMBL5051627 0.84 ATR (0.47) TLR8MAPK1USP2ALOX15MEN1
SCHEMBL5053775 0.83 TLR8 (0.50) TLR8MAPK1MEN1KMT2ADBH
SCHEMBL1666611 0.83 KEAP1 (0.48) TLR8CYP1A2CYP3A4CYP2C19CYP2C9
Hydrochloric Acid SCHEMBL1666211 0.83 TLR8 (0.50) TLR8MAPK1ADORA1MEN1KMT2A
Hydrochloric Acid SCHEMBL1666361 0.82 TLR8 (0.52) TLR8MAPK1MEN1KMT2ADBH
SCHEMBL1666165 0.82 TLR8 (0.53) TLR8MAPK1MEN1KMT2ADBH
SCHEMBL1668543 0.82 TLR8 (0.51) TLR8LMNATSHRMAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921406-B2 5-ring heteroaromatic compounds and their use as binding partners for 5-HT5 receptors AbbVie Deutschland GmbH & Co. KG (DE) 2014-12-30 US claimed
US-20150183770-A1 5-RING HETEROAROMATIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBVIE DEUTSCHLAND (DE) 2015-07-02 US disclosed
US-8921406-B2 5-ring heteroaromatic compounds and their use as binding partners for 5-HT5 receptors AbbVie Deutschland GmbH & Co. KG (DE) 2014-12-30 US disclosed
EP-1917251-B1 5-RING HETEROAROMATIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBOTT GMBH & CO KG (DE) 2013-04-03 EP disclosed
US-20110207788-A1 5-Ring Heteroaromatic compounds and their use as binding partners for 5-ht5 receptors ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2011-08-25 US disclosed
EP-2308852-A1 5-ring heteroaromatic compounds and their use as binding partners for 5-HT5 receptors Abbott GmbH & Co. KG (DE) 2011-04-13 EP disclosed
EP-1917251-A2 5-RING HETEROAROMATIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS Abbott GmbH & Co. KG (DE) 2008-05-07 EP disclosed
WO-2007022947-A2 5-RING HETEROAROMATIC 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-20150183770-A1 5-RING HETEROAROMATIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS HTR5A, HTR3A, HTR6 TLR8 3449/4885LMNA 3754/4885CYP1A2 613/4885
US-20110207788-A1 5-Ring Heteroaromatic compounds and their use as binding partners for 5-ht5 receptors HTR5A, HTR3A, HTR6 TLR8 3449/4885LMNA 3754/4885CYP1A2 613/4885

“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.