SCHEMBL23945952

SCHEMBL23945952

CNCCCNC(=O)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
KDM4E B2RXH2 2/20 0.45
MAPT P10636 1/20 0.45
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA3 P07451 2/20 0.42
CA5A P35218 2/20 0.42
CA5B Q9Y2D0 2/20 0.42
CA12 O43570 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX1 P07099 1/20 0.39
DRD4 P21917 8/20 0.39
DRD2 P14416 6/20 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
SCHEMBL14818994 0.95 POLB (0.50) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL9355210 0.91 POLB (0.57) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL10223283 0.86 POLB (0.44) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL18622113 0.85 POLB (0.57) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL10633351 0.83 MEN1 (0.58) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL14960444 0.81 RIPK1 (0.43) POLBALDH1A1SMN1; SMN2CA3CA5A
SCHEMBL25942505 0.80 POLB (0.49) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL4147505 0.80 ALDH1A1 (0.71) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL16316312 0.80 POLB (0.50) POLBKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL12264270 0.79 PGK1 (0.46) POLBALDH1A1SMN1; SMN2CA12CA2

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-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 US disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 US disclosed
WO-2022264069-A1 METHOD FOR PREPARING FLUOROPHORE- AND CHROMOPHORE-CONTAINING CONJUGATES FOR VISUAL DETECTION OF ANALYTE MOLECULES Sony Group Corporation (JP) 2022-12-22 WO disclosed
US-11352350-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-06-07 US disclosed
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2021-10-21 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 (5 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-20230278958-A1 TRICYCLIC HETEROCYCLES YAP1, TERF2IP, TEAD1 POLB 1569/4885KDM4E 2608/4885MAPT 2472/4885
US-11352350-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 POLB 2088/4885KDM4E 190/4885MAPT 2459/4885
US-20210323952-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 POLB 2088/4885KDM4E 190/4885MAPT 2459/4885
US-20230174538-A1 Tricyclic heterocycles YAP1, TEAD1, TERF2IP POLB 1991/4885KDM4E 2269/4885MAPT 2572/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 POLB 2088/4885KDM4E 190/4885MAPT 2459/4885

“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.