SCHEMBL6328796

SCHEMBL6328796

O=C1CCC(O)CN1c1c(Cl)cccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.42
P2RX7 Q99572 7/20 0.38
AADAT Q8N5Z0 1/20 0.37
MAPK14 Q16539 1/20 0.35
OPRL1 P41146 1/20 0.35
CNR2 P34972 1/20 0.34

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
SCHEMBL6335428 0.74 P2RX7 (0.39) P2RX7
SCHEMBL6326202 0.74 CYP2C9 (0.43) MAPK14
SCHEMBL6328756 0.73 P2RX7 (0.36) NOTUMP2RX7
SCHEMBL6330895 0.72 CTSS (0.42)
SCHEMBL6335435 0.72 P2RX7 (0.35) NOTUMP2RX7
SCHEMBL6336615 0.72 MEN1 (0.40) NOTUMP2RX7MAPK14
SCHEMBL6330655 0.71 KMT2A (0.36) NOTUMP2RX7MAPK14
SCHEMBL6327832 0.71 HCRTR2 (0.40) MAPK14
SCHEMBL6333186 0.70 NOTUM (0.37) NOTUMAADATCNR2
SCHEMBL6333390 0.70 MEN1 (0.44) P2RX7MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050085509-A1 Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO. LTD. (JP) 2005-04-21 US disclosed
EP-1447401-A1 PIPERIDIN-2-ONE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-08-18 EP 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-20050085509-A1 Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient MAPKAP1, MAPK1, MAPK8 NOTUM 4022/4885P2RX7 2638/4885AADAT 4435/4885

“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.