SCHEMBL5192181

SCHEMBL5192181

COC(=O)C(N)CCCC(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
PEPD P12955 1/20 0.36
ZDHHC7 Q9NXF8 1/20 0.34
LTA4H P09960 2/20 0.34
NOS2 P35228 4/20 0.33
DDAH1 O94760 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
SLC15A1 P46059 1/20 0.33
KIF11 P52732 1/20 0.33
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33
HTT P42858 1/20 0.32
SLC1A1 P43005 1/20 0.32

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
SCHEMBL5192188 1.00 CA1 (0.40) CA1CA2PEPDZDHHC7LTA4H
SCHEMBL18109682 1.00 CA1 (0.40) CA1CA2PEPDZDHHC7LTA4H
Hydrochloric Acid SCHEMBL15665036 0.98 CA1 (0.39) CA1CA2PEPDZDHHC7LTA4H
Hydrochloric Acid SCHEMBL15665037 0.98 CA1 (0.39) CA1CA2PEPDZDHHC7LTA4H
Trifluoroacetic Acid SCHEMBL29790595 0.93 S1PR1 (0.36) CA1CA2PEPDLTA4HNOS2
Trifluoroacetic Acid SCHEMBL31341361 0.93 S1PR1 (0.36) CA1CA2PEPDLTA4HNOS2
SCHEMBL1068024 0.92 CA1 (0.38) CA1CA2PEPDZDHHC7LTA4H
SCHEMBL206673 0.92 CA1 (0.38) CA1CA2PEPDZDHHC7LTA4H
Hydrochloric Acid SCHEMBL1068022 0.90 NOS2 (0.39) CA1CA2PEPDZDHHC7LTA4H
Hydrochloric Acid SCHEMBL15666248 0.90 NOS2 (0.39) CA1CA2PEPDZDHHC7LTA4H

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12377100-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2025-08-05 US disclosed
US-20220305115-A1 COMBINATION OF HEPATITIS B VIRUS (HBV) VACCINES AND PYRIDOPYRIMIDINE DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2022-09-29 US disclosed
US-20220218709-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2022-07-14 US disclosed
WO-2020255038-A1 COMBINATION OF HEPATITIS B VIRUS (HBV) VACCINES AND PYRIDOPYRIMIDINE DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2020-12-24 WO disclosed
EP-3722297-A1 TOLL-LIKE RECEPTOR MODULATING 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS Gilead Sciences, Inc. (US) 2020-10-14 EP disclosed
EP-3321265-B1 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS AND THEIR UTILISATION AS MODULATORS OF TOLL-LIKE RECEPTORS GILEAD SCIENCES INC (US) 2020-05-06 EP disclosed
US-20190282576-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2019-09-19 US disclosed
US-10285990-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2019-05-14 US disclosed
EP-3321265-A1 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS AND THEIR UTILISATION AS MODULATORS OF TOLL-LIKE RECEPTORS Gilead Sciences, Inc. (US) 2018-05-16 EP disclosed
EP-3097102-B1 TOLL-LIKE RECEPTOR MODULATING 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS GILEAD SCIENCES INC (US) 2017-10-18 EP disclosed
US-20140128386-A1 Hydroxy-substituted imidazo[1,2-a]pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US disclosed
US-20140128425-A1 Carboxy-substituted imidazo[1,2-a]pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US disclosed
US-20140128425-A1 Carboxy-substituted imidazo[1,2-a]pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US disclosed
US-20140128424-A1 Hydroxy-substituted imidazo[1,2-a]-pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US disclosed
US-20140128424-A1 Hydroxy-substituted imidazo[1,2-a]-pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US disclosed
WO-2014068095-A1 CARBOXY-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINECARBOXAMIDES AND THEIR USE AS SOLUBLE GUANYLATE CYCLASE STIMULANTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 WO disclosed
US-20140128386-A1 Hydroxy-substituted imidazo[1,2-a]pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US disclosed
US-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof SMITHKLINE BEECHAM CORPORATION (US) 2007-10-25 US disclosed
EP-1812383-A1 GLYCOGEN PHOSPHORYLASE INHIBITOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF Smithkline Beecham Corporation (US) 2007-08-01 EP disclosed
WO-2006052722-A1 GLYCOGEN PHOSPHORYLASE INHIBITOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF SMITHKLINE BEECHAM CORPORATION (US) 2006-05-18 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 (9 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-20140128386-A1 Hydroxy-substituted imidazo[1,2-a]pyridinecarboxamides and their use AADAC, TNNI3, PAH CA1 3791/4885CA2 1557/4885PEPD 133/4885
US-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof PYGM, PYGL, GYS1 CA1 2481/4885CA2 658/4885PEPD 207/4885
US-20140128425-A1 Carboxy-substituted imidazo[1,2-a]pyridinecarboxamides and their use TNNI3, CPS1, AADAC CA1 2530/4885CA2 480/4885PEPD 54/4885
US-10285990-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 CA1 4871/4885CA2 4092/4885PEPD 4069/4885
US-20140128424-A1 Hydroxy-substituted imidazo[1,2-a]-pyridinecarboxamides and their use TNNI3, AADAC, TNNT2 CA1 3822/4885CA2 1365/4885PEPD 109/4885
US-20220218709-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 CA1 4871/4885CA2 4092/4885PEPD 4069/4885
US-20190282576-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 CA1 4871/4885CA2 4092/4885PEPD 4069/4885
US-12377100-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 CA1 4871/4885CA2 4092/4885PEPD 4069/4885
US-20220305115-A1 COMBINATION OF HEPATITIS B VIRUS (HBV) VACCINES AND PYRIDOPYRIMIDINE DERIVATIVES HAVCR2, ENTPD5, HMGB3 CA1 4410/4885CA2 3460/4885PEPD 732/4885

“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.