SCHEMBL22873330

SCHEMBL22873330

CC(C)c1ccc(N2CCN(C(C)(C)C(C)(C)c3ccc(C(C)C)nc3)CC2)nc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PANK3 Q9H999 6/20 0.43
▸ SMO Q99835 2/20 0.42
▸ OGA O60502 6/20 0.41
▸ HSD11B1 P28845 1/20 0.36
▸ HSD11B2 P80365 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ KDM4E B2RXH2 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
SCHEMBL23483100 0.86 MEN1 (0.37) PANK3SMOMAPTALDH1A1CYP3A4
SCHEMBL19001135 0.78 OGA (0.44) PANK3SMOOGA
SCHEMBL20443650 0.78 PANK3 (0.42) PANK3SMOOGAMAPT
SCHEMBL10127337 0.71 HTR3A (0.49) PANK3OGAALDH1A1
SCHEMBL22005788 0.71 OGA (0.40) PANK3OGA
SCHEMBL14349207 0.70 PANK3 (0.46) PANK3SMOOGAMAPTALDH1A1
SCHEMBL13466366 0.70 CNR2 (0.48) PANK3OGAMAPTALDH1A1
SCHEMBL22006730 0.70 ALDH1A1 (0.40) PANK3HSD11B1MAPTALDH1A1GAA
SCHEMBL14924078 0.70 OGA (0.50) PANK3OGA
SCHEMBL4547927 0.69 CNR2 (0.50) PANK3OGAMAPTALDH1A1

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-11236051-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2022-02-01 — — US disclosed
US-20210009528-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas, Inc. 2021-01-14 — — 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-20210009528-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN PANK3 3092/4885SMO 409/4885OGA 1240/4885
US-11236051-B2 Compounds and methods for the targeted degradation of androgen receptor AR, ADRM1, CRBN PANK3 3092/4885SMO 409/4885OGA 1240/4885

“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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