SCHEMBL24775950

SCHEMBL24775950

CC(C)N1CCCC1c1ccn(C2CC2)n1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.36
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
ALDH1A1 P00352 1/20 0.30
MCOLN3 Q8TDD5 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
SCHEMBL8206746 0.82 ADAM17 (0.39) PARP1MGLLALDH1A1
SCHEMBL24040316 0.78 PIK3C3 (0.41) PARP1ALDH1A1
SCHEMBL2603271 0.70 CXCR4 (0.42) PARP1ALDH1A1
SCHEMBL14213448 0.70 CXCR4 (0.42) PARP1ALDH1A1
SCHEMBL12643789 0.70 CXCR4 (0.42) PARP1ALDH1A1
SCHEMBL26546843 0.69 CXCR4 (0.45) PARP1ALDH1A1
SCHEMBL23449294 0.69 PIK3C3 (0.40) PARP1
SCHEMBL23768202 0.68 WDR5 (0.39)
SCHEMBL28949648 0.68 NPC1 (0.42) FAAHMGLLALDH1A1
SCHEMBL8215223 0.68 MAP4K4 (0.38) PARP1

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 PARP1 392/4885FAAH 3175/4885MGLL 2660/4885

“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.