SCHEMBL25467800

SCHEMBL25467800

O=C1NC(=O)C(F)(F)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 1/20 0.50
▸ ITGA4 P13612 1/20 0.46
▸ CASP3 P42574 2/20 0.43
▸ CASP7 P55210 2/20 0.43
▸ CASP6 P55212 2/20 0.43
▸ CASP8 Q14790 2/20 0.43
▸ CASP2 P42575 1/20 0.43
▸ PDGFRA P16234 1/20 0.42
▸ FER P16591 1/20 0.42
▸ LTK P29376 1/20 0.42
▸ CDK8 P49336 1/20 0.42
▸ ACVR1 Q04771 1/20 0.42
▸ LRRK2 Q5S007 1/20 0.42
▸ DYRK1B Q9Y463 1/20 0.42
▸ HSD17B10 Q99714 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ AKR1A1 P14550 2/20 0.39
▸ AKR1B1 P15121 2/20 0.39
▸ TDP2 O95551 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
SCHEMBL2627036 0.75 PDK2 (0.59) GSK3BITGA4CASP3CASP7CASP6
SCHEMBL20704216 0.75 PPOX (0.55) LTKCDK8ACVR1LRRK2DYRK1B
SCHEMBL30561519 0.75 PPOX (0.55) LTKCDK8ACVR1LRRK2DYRK1B
SCHEMBL318947 0.74 PDK2 (0.57) HSD17B10KDM4EALDH1A1AKR1B1LMNA
SCHEMBL29651321 0.74 PDK2 (0.57) HSD17B10KDM4EALDH1A1AKR1B1LMNA
SCHEMBL2259995 0.73 GSK3B (0.48) GSK3BITGA4CASP3CASP7CASP6
SCHEMBL30644266 0.73 TDP2 (0.45) KDM4EALDH1A1AKR1A1AKR1B1TDP2
SCHEMBL22904372 0.73 TDP2 (0.45) KDM4EALDH1A1AKR1A1AKR1B1TDP2
SCHEMBL11705195 0.73 MEN1 (0.52) GSK3BCASP3CASP7CASP6CASP8
SCHEMBL2320531 0.71 PDK2 (0.50) ITGA4KDM4ELMNASMN1; SMN2S100A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240024318-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-01-25 — — US disclosed
US-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-01-25 — — US disclosed
US-11807636-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-11-07 — — US disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 — — US disclosed
US-11746120-B2 Stat degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-09-05 — — US disclosed
US-20230234953-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-27 — — US disclosed
US-20230219945-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-13 — — US disclosed
US-11679109-B2 SMARCA degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-06-20 — — US disclosed
US-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-18 — — US disclosed
US-20230132715-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-04 — — US 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-20230132715-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 GSK3B 663/4885ITGA4 3699/4885CASP3 816/4885
US-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF MDM2, TP53, MDM4 GSK3B 668/4885ITGA4 4608/4885CASP3 920/4885
US-20230234953-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 GSK3B 663/4885ITGA4 3699/4885CASP3 816/4885
US-20240024318-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCA2, SMARCC2 GSK3B 3377/4885ITGA4 3910/4885CASP3 3015/4885
US-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCB1, SMARCE1 GSK3B 2005/4885ITGA4 3162/4885CASP3 4064/4885
US-11746120-B2 Stat degraders and uses thereof STAT4, STAT1, STAT3 GSK3B 328/4885ITGA4 3862/4885CASP3 1330/4885
US-20230219945-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 GSK3B 663/4885ITGA4 3699/4885CASP3 816/4885
US-11807636-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 GSK3B 663/4885ITGA4 3699/4885CASP3 816/4885
US-11679109-B2 SMARCA degraders and uses thereof SMARCA1, SMARCA2, SMARCC2 GSK3B 3377/4885ITGA4 3910/4885CASP3 3015/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 GSK3B 663/4885ITGA4 3699/4885CASP3 816/4885

“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.

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