SCHEMBL4496907

SCHEMBL4496907

CCCN1CCC(NCc2ccccc2C(=O)N(CC)CC)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
MITF O75030 1/20 0.45
MAPT P10636 1/20 0.45
ATM Q13315 1/20 0.45
OPRD1 P41143 1/20 0.44
BCHE P06276 1/20 0.44
ACHE P22303 1/20 0.44
BACE1 P56817 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
PARP1 P09874 1/20 0.40
DRD2 P14416 1/20 0.40

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
SCHEMBL4496904 0.79 CARM1 (0.48) OPRD1ACHEBACE1CARM1PRMT6
SCHEMBL24260275 0.74 SCN1A (0.44) KDM4EALDH1A1BCHEACHEBACE1
SCHEMBL4499743 0.73 CARM1 (0.74) BCHEACHEBACE1CARM1PRMT6
SCHEMBL24260218 0.72 ADRB2 (0.45) KDM4EALDH1A1MITFBCHEACHE
SCHEMBL6647138 0.70 TP53 (0.55) ALDH1A1HPGDMAPTL3MBTL1
SCHEMBL7287054 0.69 HCRTR1 (0.60) ALDH1A1HPGDMAPT
SCHEMBL4499136 0.69 OPRD1 (0.53) OPRD1
SCHEMBL4394632 0.69 CRBN (0.47)
SCHEMBL4389298 0.69 CRBN (0.47)
SCHEMBL4387846 0.69 CRBN (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576105-B2 Benzyl substituted (piperidin-4-yl)aminobenzamido derivatives JANSSEN PHARMACEUTICA, NV (BE) 2009-08-18 US disclosed
US-20060106066-A1 Benzyl substituted (piperidin-4-yl)aminobenzamido derivatives BAXTER ELLEN W 2006-05-18 US disclosed
US-20040082612-A1 Benzyl substituted (piperidin-4-yl)aminobenzamido derivatives JANSSEN PHARMACEUTICALS N.V. (BE) 2004-04-29 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 (2 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-20060106066-A1 Benzyl substituted (piperidin-4-yl)aminobenzamido derivatives OPRD1, OPRK1, OPRM1 KDM4E 896/4885ALDH1A1 1443/4885HPGD 2946/4885
US-20040082612-A1 Benzyl substituted (piperidin-4-yl)aminobenzamido derivatives OPRD1, OPRK1, OPRM1 KDM4E 896/4885ALDH1A1 1443/4885HPGD 2946/4885

“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.