SCHEMBL4983013

SCHEMBL4983013

CN1CCC(NC(=O)NCc2ccco2)CC1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 1/20 0.54
ALDH1A1 P00352 3/20 0.53
POLB P06746 1/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
EPHX2 P34913 4/20 0.51
TDP1 Q9NUW8 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL4979024 0.88 CYP3A4 (0.45) KDM5BALDH1A1POLBTSHRMAPK1
SCHEMBL5128656 0.84 USP2 (0.61) ALDH1A1TSHRSMN1; SMN2EPHX2TDP1
SCHEMBL4981629 0.80 DRD4 (0.44) ALDH1A1TSHRSMN1; SMN2CYP3A4
SCHEMBL4220447 0.79 USP2 (0.67) ALDH1A1POLBMAPK1TDP1L3MBTL1
SCHEMBL14263114 0.79 DRD4 (0.73) POLBSMN1; SMN2EPHX2
SCHEMBL10210809 0.78 KDM5B (0.55) KDM5BALDH1A1POLBMAPK1SMN1; SMN2
SCHEMBL4981056 0.77 ALDH1A1 (0.55) ALDH1A1POLBTSHRSMN1; SMN2
SCHEMBL4981471 0.76 ALDH1A1 (0.64) ALDH1A1EPHX2TDP1
SCHEMBL4982809 0.76 DRD4 (0.49) ALDH1A1SMN1; SMN2EPHX2
SCHEMBL5465155 0.76 KMT2A (0.57) ALDH1A1POLBTSHRSMN1; SMN2CYP2C9

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-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands ASTRAZENECA AB (SE) 2008-03-13 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-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands HRH3, HRH1, HRH4 KDM5B 796/4885ALDH1A1 451/4885POLB 3173/4885

“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.