SCHEMBL24774829

SCHEMBL24774829

CN(C)CCc1ccccc1C1CCCN1C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 4/20 0.39
▸ HTR6 P50406 1/20 0.37
▸ HTR2A P28223 4/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ SIGMAR1 Q99720 2/20 0.33
▸ CHRNA7 P36544 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ SLC6A2 P23975 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32
▸ BCHE P06276 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
SCHEMBL24853959 0.92 SLC6A4 (0.37) HTR6HTR2AHTR2CHTR2BHRH1
SCHEMBL24775357 0.86 SLC6A2 (0.35) SIGMAR1CHRNA7SLC6A2SLC6A3
SCHEMBL24775061 0.85 CHRNA7 (0.35) HTR1ACHRNA7DRD2
SCHEMBL24774767 0.83 LIPG (0.38) HTR1ASIGMAR1CHRNA7DRD2BCHE
SCHEMBL23323081 0.82 CHRNB2 (0.47) TAAR1HTR6CHRNA7
SCHEMBL24775073 0.82 RIPK1 (0.38) CHRNA7
SCHEMBL24774831 0.81 RIPK1 (0.38) CHRNA7
SCHEMBL24854069 0.80 CHRNA7 (0.35) HTR6CHRNA7BCHE
SCHEMBL24774830 0.78 CHRNA7 (0.34) CHRNA7
SCHEMBL24775456 0.77 HSP90AA1 (0.44) HTR2CCHRNA7

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-20220402915-A1 BCL-2 INHIBITORS BEONE MEDICINES I GMBH (CH) 2022-12-22 — — 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-20220402915-A1 BCL-2 INHIBITORS BCL2, BCL2L1, BCL2L2 TAAR1 4675/4885HTR6 3133/4885HTR2A 2862/4885

“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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