SCHEMBL27057437

SCHEMBL27057437

CC(C)C#CC1CCN(C(=O)C(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CHRNB2 P17787 1/20 0.38
▸ CHRNA3 P32297 1/20 0.38
▸ CHRNA4 P43681 1/20 0.38
▸ CHRNB3 Q05901 1/20 0.38
▸ CHRNA6 Q15825 1/20 0.38
▸ EPHX2 P34913 4/20 0.35
▸ NAMPT P43490 1/20 0.35
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ SLC9A1 P19634 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ L3MBTL1 Q9Y468 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
SCHEMBL23509414 0.84 PIK3CD (0.39) MEN1ALDH1A1KMT2AEPHX2CYP2D6
SCHEMBL23842279 0.79 EPHX2 (0.43) ALDH1A1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL23945967 0.79 ALDH1A1 (0.33) ALDH1A1EPHX2
SCHEMBL23509502 0.79 — —
SCHEMBL23105073 0.78 POLB (0.45) MEN1ALDH1A1KMT2AEPHX2CYP2C9
SCHEMBL23710960 0.78 CPN1 (0.44) ALDH1A1
SCHEMBL19652203 0.78 MEN1 (0.43) MEN1ALDH1A1KMT2ACHRNB2CHRNA3
SCHEMBL22525774 0.77 ALDH1A1 (0.34) MEN1ALDH1A1KMT2AEPHX2
SCHEMBL12376562 0.76 HPGD (0.49) ALDH1A1HRH3L3MBTL1
SCHEMBL24233080 0.72 HRH3 (0.34) CYP2D6KCNH2HRH3

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-20240025878-A1 MDM2 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF MDM2, TP53, MDM4 MEN1 2268/4885ALDH1A1 1804/4885KMT2A 1193/4885

“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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