SCHEMBL1905656

SCHEMBL1905656

CC1(C)C(=O)N(C2[C@@H]3CC4C[C@H]2CC(F)(C4)C3)C1c1cccc(Cl)c1Cl

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.31
ACHE P22303 1/20 0.31
P2RX7 Q99572 1/20 0.30
HSD11B1 P28845 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
SCHEMBL11956522 1.00 SCN9A (0.31) SCN9AACHEP2RX7HSD11B1
SCHEMBL1905654 1.00 SCN9A (0.31) SCN9AACHEP2RX7HSD11B1
SCHEMBL11975554 0.89 HSD11B1 (0.33) ACHEP2RX7HSD11B1
SCHEMBL11976945 0.89 HSD11B1 (0.33) ACHEP2RX7HSD11B1
SCHEMBL1895230 0.88 ACHE (0.31) SCN9AACHEP2RX7HSD11B1
SCHEMBL11956498 0.88 ACHE (0.31) SCN9AACHEP2RX7HSD11B1
SCHEMBL1906217 0.88 ACHE (0.31) SCN9AACHEP2RX7HSD11B1
SCHEMBL11956497 0.88 ACHE (0.31) SCN9AACHEP2RX7HSD11B1
SCHEMBL1895228 0.88 ACHE (0.31) SCN9AACHEP2RX7HSD11B1
SCHEMBL1907219 0.87 HSD11B1 (0.39) HSD11B1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236789-B2 1-adamantyl azetidin-2-one derivatives and drugs containing same KOWA COMPANY, LTD. (JP) 2012-08-07 US claimed
EP-2322505-A1 1-ADAMANTYLAZETIDIN-2-ONE DERIVATIVE AND PHARMACEUTICAL PREPARATION COMPRISING SAME Kowa Company, Ltd. (JP) 2011-05-18 EP claimed
US-20100075943-A1 1-ADAMANTYLAZETIDIN-2-ONE DERIVATIVES AND DRUGS CONTAINING SAME KOWA COMPANY, LTD., (JP) 2010-03-25 US claimed
US-8236789-B2 1-adamantyl azetidin-2-one derivatives and drugs containing same KOWA COMPANY, LTD. (JP) 2012-08-07 US disclosed
EP-2322505-A1 1-ADAMANTYLAZETIDIN-2-ONE DERIVATIVE AND PHARMACEUTICAL PREPARATION COMPRISING SAME Kowa Company, Ltd. (JP) 2011-05-18 EP disclosed
US-20100075943-A1 1-ADAMANTYLAZETIDIN-2-ONE DERIVATIVES AND DRUGS CONTAINING SAME KOWA COMPANY, LTD., (JP) 2010-03-25 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-20100075943-A1 1-ADAMANTYLAZETIDIN-2-ONE DERIVATIVES AND DRUGS CONTAINING SAME HSD11B1, HSD3B1, CYP46A1 SCN9A 993/4885ACHE 3040/4885P2RX7 4863/4885

“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.