SCHEMBL24673558

SCHEMBL24673558

C=C(NCCCCCNC)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.41
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
HIF1A Q16665 1/20 0.34
KISS1R Q969F8 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
PAOX Q6QHF9 1/20 0.31
ALDH1A2 O94788 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALDH2 P05091 1/20 0.31
ALDH1A3 P47895 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
KDM4A O75164 1/20 0.30
KDM4C Q9H3R0 1/20 0.30

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
SCHEMBL25881544 1.00 EPHX1 (0.41) EPHX1KDM4EMAPK1HIF1AKISS1R
SCHEMBL27382307 0.93 KISS1R (0.33) EPHX1KISS1R
SCHEMBL24607200 0.84 MEN1 (0.35) KDM4EALDH1A1
SCHEMBL24797179 0.84
SCHEMBL25881306 0.83 EPHX1 (0.50) EPHX1ZDHHC20ZDHHC2
SCHEMBL25697792 0.83 EPHX1 (0.50) EPHX1ZDHHC20ZDHHC2
SCHEMBL22861925 0.83 EPHX1 (0.50) EPHX1ZDHHC20ZDHHC2
SCHEMBL19057654 0.83 EPHX1 (0.50) EPHX1ZDHHC20ZDHHC2
SCHEMBL21105785 0.81 EPHX1 (0.33) EPHX1KISS1R
SCHEMBL23961781 0.81 PAOX (0.50) PAOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230132715-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-04 US disclosed
US-20220340570-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2022-10-27 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 (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-20230132715-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 EPHX1 1684/4885KDM4E 190/4885MAPK1 2017/4885
US-20220340570-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 EPHX1 1684/4885KDM4E 190/4885MAPK1 2017/4885

“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.