SCHEMBL29319871

SCHEMBL29319871

COC1C2CC3(C(=S)N[C@H]4CC[C@H](CN)CC4)CC1CC(c1ccccc1)(C2)C3

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
THRB P10828 1/20 0.33
ALOX12 P18054 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM1A O60341 1/20 0.32
MAOB P27338 1/20 0.32
DPP4 P27487 1/20 0.31

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
SCHEMBL29319875 0.90 CHRM2 (0.34) LMNACHRM2CHRM1CHRM3THRB
SCHEMBL29319880 0.89 CHRM2 (0.34) LMNACHRM2CHRM1CHRM3KDM1A
SCHEMBL29319888 0.89 CHRM2 (0.34) LMNACHRM2CHRM1CHRM3KDM1A
SCHEMBL24138736 0.89 CHRM2 (0.36) LMNACHRM2CHRM1CHRM3THRB
SCHEMBL29319662 0.89 KDM1A (0.39) LMNAKDM1AMAOB
SCHEMBL29319886 0.87 EPHX2 (0.35) CHRM2CHRM1CHRM3KDM1AMAOB
SCHEMBL29338354 0.87 CHRM2 (0.35) LMNACHRM2CHRM1CHRM3KDM1A
SCHEMBL29338306 0.87 CHRM2 (0.35) LMNACHRM2CHRM1CHRM3KDM1A
SCHEMBL29319892 0.86 CHRM2 (0.35) LMNACHRM2CHRM1CHRM3KDM1A
SCHEMBL29331957 0.86 CHRM2 (0.36) LMNACHRM2CHRM1CHRM3THRB

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-20240238265-A1 ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION ARISAN THERAPEUTICS INC. (US) 2024-07-18 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-20240238265-A1 ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION IFNAR1, NR4A3, NR0B2 LMNA 3555/4885CHRM2 2158/4885CHRM1 2064/4885

“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.