SCHEMBL2157388

SCHEMBL2157388

Cc1ccccc1OCCN1CCN(C(=O)CCCC2=COC=C(C3=CC=CCC3)O2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 3/20 0.42
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 3/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
AR P10275 1/20 0.34
NOTUM Q6P988 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
DRD2 P14416 1/20 0.34
DRD3 P35462 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
SCHEMBL3373664 0.86 LMNA (0.40) KCNA5MEN1KMT2AALDH1A1HPGD
SCHEMBL5774806 0.73 MEN1 (0.30) MEN1KMT2A
SCHEMBL3775162 0.72 MEN1 (0.41) MEN1KMT2ANPSR1CYP2C19RAB9A
Hydrochloric Acid SCHEMBL2230783 0.70
SCHEMBL15209637 0.69 UGCG (0.40) TDP1MEN1KMT2AKDM4ENPSR1
SCHEMBL2157385 0.69 MEN1 (0.51) KCNA5TDP1MEN1KMT2AKDM4E
SCHEMBL2397103 0.67 SCN4A (0.43) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL7130709 0.66 L3MBTL1 (0.41) MEN1KMT2AKDM4ENPSR1ALDH1A1
SCHEMBL3771407 0.65 KCNJ1 (0.32) SIGMAR1
SCHEMBL5746373 0.64 KDM4E (0.30) KDM4EALDH1A1TSHR

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-8183374-B2 Piperidine and piperazine derivatives M'S SCIENCE CORPORATION (JP) 2012-05-22 US disclosed
EP-2340835-A1 Piperidine and piperazine derivatives M's Science Corporation (JP) 2011-07-06 EP disclosed
EP-1976525-B1 PIPERIDINE AND PIPERAZINE DERIVATIVES MS SCIENCE CORP (JP) 2010-11-03 EP disclosed
US-20100137334-A1 Piperidine and Piperazine Derivatives SUN CONNIE L 2010-06-03 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-20100137334-A1 Piperidine and Piperazine Derivatives SIGMAR1, OPRM1, OPRD1 KCNA5 273/4885TDP1 2763/4885MEN1 2035/4885

“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.