SCHEMBL21867124

SCHEMBL21867124

CC(C)N1CCN(C(=O)O)CC1C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.36
SLC6A9 P48067 2/20 0.35
CHRM1 P11229 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CCR5 P51681 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
CYP2D6 P10635 1/20 0.31
KCNH2 Q12809 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL4668634 0.86 HRH3 (0.42) HRH3SMN1; SMN2ALDH1A1
SCHEMBL25704492 0.85 PIK3CD (0.40) HRH3SLC6A9SMN1; SMN2KMT2A
SCHEMBL23312132 0.81 SLC6A9 (0.31) HRH3SLC6A9SMN1; SMN2MEN1ALDH1A1
SCHEMBL29115965 0.80 CHRM1 (0.31) SLC6A9CHRM1
SCHEMBL23876808 0.80 MEN1 (0.36) HRH3SLC6A9MEN1KMT2AEGLN1
SCHEMBL20314879 0.80 JAK3 (0.38)
SCHEMBL23569900 0.80 JAK3 (0.38)
SCHEMBL23133923 0.80 MEN1 (0.36) HRH3SLC6A9MEN1KMT2AEGLN1
SCHEMBL23308415 0.80 JAK3 (0.38)
SCHEMBL3867178 0.79 ALDH1A1 (0.50) HRH3SMN1; SMN2MEN1ALDH1A1KMT2A

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-10632128-B2 Compounds that inhibit Mcl-1 protein AMGEN INC. (US) 2020-04-28 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-10632128-B2 Compounds that inhibit Mcl-1 protein MCL1, BCL9, BCL2L1 HRH3 4690/4885SLC6A9 4485/4885CHRM1 4872/4885

“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.