SCHEMBL30997610

SCHEMBL30997610

CN1CC2CCC1CN2Nc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 2/20 0.35
▸ CHRNA7 P36544 4/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ CARM1 Q86X55 1/20 0.33
▸ PRMT6 Q96LA8 1/20 0.33
▸ CHRNB2 P17787 1/20 0.33
▸ CHRNB4 P30926 1/20 0.33
▸ CHRNA3 P32297 1/20 0.33
▸ CHRNA4 P43681 1/20 0.33

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
SCHEMBL30997650 0.86 CHRNA7 (0.43) CHRM3CHRNA7KCNH2CHRM2CHRM1
SCHEMBL31053525 0.74 TDP1 (0.34) CHRNA7HRH3TDP1SLC6A2SLC6A3
SCHEMBL29580440 0.71 SLC6A2 (0.42) CHRM3CHRNA7KCNH2SLC6A2SLC6A3
SCHEMBL30997629 0.71 HRH3 (0.40) CHRM3HRH3TDP1SLC6A2SLC6A3
SCHEMBL30997648 0.71 SLC6A2 (0.42) CHRM3CHRNA7KCNH2SLC6A2SLC6A3
SCHEMBL6859733 0.70 TDP1 (0.39) TDP1SLC6A2
SCHEMBL25646900 0.69 CHRNA7 (0.43) CHRM3CHRNA7KCNH2HRH3CHRNB2
SCHEMBL21142813 0.69 CHRNA7 (0.43) CHRM3CHRNA7KCNH2HRH3CHRNB2
SCHEMBL30912574 0.69 CHRNA7 (0.43) CHRM3CHRNA7KCNH2SLC6A2SLC6A3
SCHEMBL2390266 0.69 TDP1 (0.31) TDP1

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-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. 2024-07-11 — — 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-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF WEE1, WEE2, DCLRE1B CHRM3 4882/4885CHRNA7 4854/4885KCNH2 4857/4885

“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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