SCHEMBL4975754

SCHEMBL4975754

CN1CCC(NC(=O)NCCc2ccncc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
MAPT P10636 1/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
EPHX2 P34913 1/20 0.53
ATM Q13315 1/20 0.47
HSD17B10 Q99714 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NAMPT P43490 2/20 0.46
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SIGMAR1 Q99720 1/20 0.44
SSTR4 P31391 1/20 0.43

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
SCHEMBL14263082 0.87 EPHX1 (0.71) EPHX1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL14263117 0.86 EPHX1 (0.55) EPHX1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL14263118 0.85 EPHX2 (0.52) EPHX1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL4981608 0.82 SMN1; SMN2 (0.57) EPHX1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL10285704 0.82 KDM4E (0.57) TSHRHSD17B10KDM4EMEN1KMT2A
SCHEMBL13621157 0.80 SIGMAR1 (0.66) EPHX2MEN1KMT2ASIGMAR1SSTR4
SCHEMBL358475 0.80 NAMPT (0.64) EPHX1SMN1; SMN2RAB9AMAPTNAMPT
SCHEMBL4981401 0.79 SMN1; SMN2 (0.54) EPHX1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL14263116 0.78 ALDH1A1 (0.48) EPHX1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL14263098 0.77 MEN1 (0.77) EPHX1SMN1; SMN2MAPTTSHRKDM4E

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 EPHX1 1415/4885SMN1; SMN2 4046/4885NPC1 4132/4885

“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.