SCHEMBL24775503

SCHEMBL24775503

CC(C)(C)N1CCCC1c1cc(S(C)(=O)=O)ccc1C1CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 3/20 0.41
▸ DRD2 P14416 3/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ SLC6A9 P48067 1/20 0.38
▸ PTGS2 P35354 1/20 0.36
▸ NR1H2 P55055 1/20 0.36
▸ NR1H3 Q13133 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ SLC6A2 P23975 2/20 0.35
▸ SLC6A4 P31645 2/20 0.35
▸ SLC6A3 Q01959 2/20 0.35
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ KDM2B Q8NHM5 1/20 0.34
▸ HRH4 Q9H3N8 1/20 0.34
▸ HSD11B1 P28845 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
SCHEMBL24774474 0.80 SIGMAR1 (0.37) DRD2DRD3SIGMAR1CHRNB2CHRNA4
SCHEMBL24774477 0.79 OPRM1 (0.42) CHRNB2CHRNA4
SCHEMBL24775499 0.79 OPRM1 (0.42) CHRNB2CHRNA4
SCHEMBL24774489 0.79 TMEM97 (0.43) SIGMAR1CHRNB2CHRNA4
SCHEMBL24775160 0.76 CHRNA7 (0.39) CHRNB2CHRNA4
SCHEMBL24775973 0.76 CHRNA7 (0.39) CHRNB2CHRNA4
SCHEMBL24775976 0.76 CHRNA7 (0.39) CHRNB2CHRNA4
SCHEMBL24774497 0.74 CHRNA7 (0.39) DRD2
SCHEMBL24775427 0.74 RIPK1 (0.33) —
SCHEMBL24775980 0.72 CHRNA7 (0.38) CHRNB2CHRNA4

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 GPR119 653/4885DRD2 4268/4885DRD3 4706/4885

“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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