SCHEMBL25930930

SCHEMBL25930930

CNC(C)C(=O)N1CCC(N)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ GNAI3 P08754 1/20 0.39
▸ GNAO1 P09471 1/20 0.39
▸ GNAI1 P63096 1/20 0.39
▸ DPP4 P27487 7/20 0.37
▸ DPP8 Q6V1X1 3/20 0.37
▸ DPP9 Q86TI2 2/20 0.37
▸ ITGB3 P05106 2/20 0.36
▸ ITGA2B P08514 2/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ EPHX2 P34913 3/20 0.36
▸ SMYD3 Q9H7B4 1/20 0.35
▸ DPP7 Q9UHL4 1/20 0.34

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
SCHEMBL11983556 0.83 ALDH1A1 (0.61) MEN1ALDH1A1KMT2A
SCHEMBL3059596 0.80 MEN1 (0.47) MEN1ALDH1A1KMT2AGNAI3GNAO1
SCHEMBL985369 0.79 MEN1 (0.46) MEN1ALDH1A1KMT2AGNAI3GNAO1
SCHEMBL985368 0.79 MEN1 (0.46) MEN1ALDH1A1KMT2AGNAI3GNAO1
Hydrochloric Acid SCHEMBL17796058 0.79 GNAI3 (0.46) MEN1ALDH1A1KMT2AGNAI3GNAO1
SCHEMBL17287129 0.78 MMP1 (0.41) MEN1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL985143 0.77 GNAI3 (0.45) MEN1ALDH1A1KMT2AGNAI3GNAO1
Hydrochloric Acid SCHEMBL985144 0.77 GNAI3 (0.45) MEN1ALDH1A1KMT2AGNAI3GNAO1
SCHEMBL13866419 0.76 MMP1 (0.44) ALDH1A1DPP4EPHX2DPP7
SCHEMBL10280581 0.76 MEN1 (0.43) MEN1ALDH1A1KMT2AGNAI3GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242548-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-08-03 — — 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-20230242548-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER KRAS, HRAS, NRAS MEN1 2804/4885ALDH1A1 2792/4885KMT2A 1832/4885

“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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