SCHEMBL25628587

SCHEMBL25628587

CC(C)c1ccccc1C1COCCN1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
ACHE P22303 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
BACE1 P56817 1/20 0.32
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30
DPP4 P27487 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
MAPT P10636 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
SCHEMBL25478279 0.84 ADRB2 (0.36) ADRB2ADRB1ADRB3ACHEBACE1
SCHEMBL24005468 0.84 ACHE (0.38) ADRB2ADRB1ADRB3ACHECNR1
SCHEMBL25628790 0.81 KCNA5 (0.31)
SCHEMBL25613519 0.80 ACHE (0.35) ADRB2ADRB1ADRB3ACHE
SCHEMBL4095123 0.80 DRD2 (0.40) MAPT
SCHEMBL2603317 0.78 PIK3C3 (0.41) BACE1
SCHEMBL18913836 0.78 PIK3C3 (0.41) BACE1
SCHEMBL22213815 0.78 PIK3C3 (0.41) BACE1
SCHEMBL24775488 0.77 CHRNA7 (0.38)
SCHEMBL24775445 0.76 PARP1 (0.39)

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-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-25 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-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS BCL2, BCL2L2, BCL2L1 ADRB2 3492/4885ADRB1 4352/4885ADRB3 4390/4885

“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.