SCHEMBL1906217

SCHEMBL1906217

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

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.31
P2RX7 Q99572 2/20 0.31
HSD11B1 P28845 1/20 0.31
TSHR P16473 2/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
SCN9A Q15858 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
SCHEMBL11956498 1.00 ACHE (0.31) ACHEP2RX7HSD11B1TSHRHTR2A
SCHEMBL1895230 1.00 ACHE (0.31) ACHEP2RX7HSD11B1TSHRHTR2A
SCHEMBL11956497 1.00 ACHE (0.31) ACHEP2RX7HSD11B1TSHRHTR2A
SCHEMBL1895228 1.00 ACHE (0.31) ACHEP2RX7HSD11B1TSHRHTR2A
SCHEMBL11975554 0.90 HSD11B1 (0.33) ACHEP2RX7HSD11B1TSHRHTR2A
SCHEMBL11976945 0.90 HSD11B1 (0.33) ACHEP2RX7HSD11B1TSHRHTR2A
SCHEMBL11956522 0.88 SCN9A (0.31) ACHEP2RX7HSD11B1SCN9A
SCHEMBL1907219 0.88 HSD11B1 (0.39) HSD11B1
SCHEMBL1905656 0.88 SCN9A (0.31) ACHEP2RX7HSD11B1SCN9A
SCHEMBL1905654 0.88 SCN9A (0.31) ACHEP2RX7HSD11B1SCN9A

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 ACHE 3040/4885P2RX7 4863/4885HSD11B1 1/4885

“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.