SCHEMBL3197974

SCHEMBL3197974

COc1cccc(F)c1Cc1cc2ccccc2nc1N

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 13/20 0.54
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
DHFR P00374 2/20 0.42
RPS6KA2 Q15349 1/20 0.39
DCPS Q96C86 1/20 0.39
PDE10A Q9Y233 1/20 0.39

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
SCHEMBL3206611 0.91 TLR8 (0.60) TLR8MEN1KMT2ADCPSPDE10A
SCHEMBL3197519 0.89 TLR8 (0.40) TLR8MEN1KMT2ADHFRRPS6KA2
SCHEMBL3215454 0.89 TLR8 (0.40) TLR8MEN1KMT2ADHFRRPS6KA2
Hydrochloric Acid SCHEMBL3209347 0.87 TLR8 (0.56) TLR8DHFRDCPS
SCHEMBL4718173 0.86 MPO (0.39) TLR8MEN1KMT2ADHFRRPS6KA2
SCHEMBL3215535 0.86 DPP4 (0.39) TLR8MEN1KMT2ADHFRRPS6KA2
Hydrochloric Acid SCHEMBL3209824 0.86 TLR8 (0.55) TLR8DHFRDCPS
SCHEMBL3210319 0.86 DPP4 (0.39) TLR8MEN1KMT2ARPS6KA2
SCHEMBL3209362 0.86 PDE10A (0.39) TLR8DHFRRPS6KA2PDE10A
SCHEMBL3217299 0.85 TLR8 (0.54) TLR8MEN1KMT2ADCPSPDE10A

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 TLR8 3013/4885MEN1 2777/4885KMT2A 3808/4885
US-20100041698-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS HTR5A, HTR1A, HTR2C TLR8 3013/4885MEN1 2777/4885KMT2A 3808/4885

“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.