SCHEMBL6335191

SCHEMBL6335191

O=C(NCc1ccccc1CC1CCC(=O)N(c2c(Cl)cccc2Cl)C1)NC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.46
MAPT P10636 3/20 0.46
HPGD P15428 2/20 0.46
EPHX1 P07099 3/20 0.44
MAPK8 P45983 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL6328449 0.86 P2RX7 (0.45) NPC1RAB9A
SCHEMBL6330616 0.86 POLB (0.43) ALDH1A1KDM4EMAPK1NPC1RAB9A
SCHEMBL6328358 0.85 KMT2A (0.45) MAPTHPGDNPC1RAB9AKMT2A
SCHEMBL6335094 0.84 P2RX7 (0.45)
SCHEMBL6328606 0.81 P2RX7 (0.45)
SCHEMBL6330046 0.80 PTGER3 (0.44) HPGDALDH1A1NPC1RAB9ATSHR
SCHEMBL6328756 0.79 P2RX7 (0.36) MAPTKMT2ATSHR
SCHEMBL6334293 0.78 DCUN1D1 (0.50) MAPTRAB9AKMT2A
SCHEMBL6335428 0.78 P2RX7 (0.39) MAPTALDH1A1KMT2ATSHR
SCHEMBL6327559 0.77 MAPK14 (0.46) MAPT

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 4 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 claimed
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 claimed
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 EPHX2 4560/4885MAPT 185/4885HPGD 3810/4885

“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.