SCHEMBL868879

SCHEMBL868879

O=C(O)Cc1cccc(C(F)(F)F)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.50
MAOB P27338 1/20 0.44
TAS2R14 Q9NYV8 1/20 0.43
SYK P43405 2/20 0.42
GLS O94925 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4D Q08499 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ADAMTS4 O75173 1/20 0.40
MMP13 P45452 1/20 0.40
MBOAT4 Q96T53 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
ADORA2A P29274 1/20 0.39
AHR P35869 1/20 0.38
NR3C1 P04150 1/20 0.38
PGK1 P00558 1/20 0.38
PGK2 P07205 1/20 0.38

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
SCHEMBL29755971 1.00 P2RX7 (0.50) P2RX7MAOBTAS2R14SYKGLS
SCHEMBL31645933 0.84 MAOB (0.55) P2RX7MAOBTAS2R14SYKGLS
SCHEMBL2312720 0.84 MAOB (0.55) P2RX7MAOBTAS2R14SYKGLS
SCHEMBL26046016 0.84 P2RX7 (0.49) P2RX7MAOBTAS2R14GLSADAMTS4
SCHEMBL4495296 0.80 AKR1B1 (0.48) KDM4ESMN1; SMN2PGK1PGK2
SCHEMBL31646435 0.80 P2RX7 (0.49) P2RX7MAOBTAS2R14SYKKDM4E
SCHEMBL534133 0.78 SYK (0.47) P2RX7MAOBSYKCYP2C19SMN1; SMN2
SCHEMBL30864787 0.78 SYK (0.47) P2RX7MAOBSYKCYP2C19SMN1; SMN2
SCHEMBL2373934 0.78 P2RX7 (0.43) P2RX7MAOBTAS2R14SYKADAMTS4
SCHEMBL30156698 0.77 P2RX7 (0.47) P2RX7MAOBTAS2R14GLSMBOAT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260042749-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2026-02-12 US disclosed
US-12545659-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2026-02-10 US disclosed
US-20240382488-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-11-21 US disclosed
US-20240317752-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-09-26 US disclosed
US-20240059674-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-02-22 US disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-20230087342-A1 AZEPANE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 2023-03-23 US disclosed
US-20230069104-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-03-02 US disclosed
WO-2022212326-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2022-10-06 WO disclosed
WO-2015056180-A1 INDOLINE DERIVATIVES AS INHIBITORS OF PERK GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-04-23 WO disclosed
EP-2549868-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2015-01-07 EP disclosed
CN-104114543-A Therapeutically active compounds and methods of use thereof AGIOS PHARMACEUTICALS INC 2014-10-22 CN disclosed
CN-102917588-B Chemical compounds GLAXOSMITHKLINE LLC (US) 2014-10-08 CN disclosed
US-8598156-B2 Chemical compounds GLAXOSMITHKLINE LLC (US) 2013-12-03 US disclosed
CN-102119029-B 1, 5-diphenyl-pyrrolidin-2-one compounds as CB-1 ligands LILLY CO ELI 2013-03-13 CN disclosed
EP-2549868-A1 CHEMICAL COMPOUNDS GlaxoSmithKline LLC (US) 2013-01-30 EP disclosed
US-20130018038-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2013-01-17 US disclosed
US-20120077828-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2012-03-29 US disclosed
WO-2011119663-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-09-29 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 (10 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-12545659-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK4 P2RX7 3982/4885MAOB 3872/4885TAS2R14 2137/4885
US-20240382488-A1 NEK7 INHIBITORS NEK7, NEK11, NEK2 P2RX7 472/4885MAOB 1758/4885TAS2R14 4272/4885
US-20130018038-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R P2RX7 3466/4885MAOB 2391/4885TAS2R14 4109/4885
US-20240317752-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES TYMP, DPYD, PNP P2RX7 95/4885MAOB 446/4885TAS2R14 4174/4885
US-20120077828-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R P2RX7 3466/4885MAOB 2391/4885TAS2R14 4109/4885
US-20260042749-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK4 P2RX7 1935/4885MAOB 2531/4885TAS2R14 1659/4885
US-20230087342-A1 AZEPANE DERIVATIVE ADCY10, AZI2, PRMT1 P2RX7 1949/4885MAOB 714/4885TAS2R14 698/4885
US-20240059674-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 P2RX7 1103/4885MAOB 2743/4885TAS2R14 3823/4885
US-20230069104-A1 IRAK DEGRADERS AND USES THEREOF IRAK4, IRAK2, IRAK3 P2RX7 4079/4885MAOB 3579/4885TAS2R14 4443/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 P2RX7 1103/4885MAOB 2743/4885TAS2R14 3823/4885

“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.