SCHEMBL314528

SCHEMBL314528

CN1CCC(NC(=O)N2CCN(c3ccccc3Cl)CC2)CC1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.55
RAB9A P51151 1/20 0.55
HTR1A P08908 1/20 0.54
HTR1D P28221 1/20 0.54
HTR1B P28222 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
HTR7 P34969 1/20 0.54
HTR6 P50406 1/20 0.54
GAA P10253 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
CYP46A1 Q9Y6A2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
DRD2 P14416 1/20 0.48
DRD3 P35462 1/20 0.48
SSTR1 P30872 1/20 0.48
SSTR4 P31391 1/20 0.48
RBP4 P02753 1/20 0.48
HRH3 Q9Y5N1 2/20 0.48
AKR1C3 P42330 1/20 0.48

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
SCHEMBL314504 0.87 GAA (0.68) P2RX4RAB9AGAASMN1; SMN2CYP46A1
SCHEMBL314463 0.84 HTR1A (0.62) P2RX4RAB9AHTR1AHTR1DHTR1B
SCHEMBL4978037 0.84 RAB9A (0.52) P2RX4RAB9AHTR1AHTR7GAA
SCHEMBL314521 0.81 MAPT (0.58) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL4981621 0.79 LMNA (0.51) P2RX4RAB9ASMN1; SMN2CYP46A1ALDH1A1
SCHEMBL3412870 0.78 DRD2 (0.74) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL3412869 0.78 DRD2 (0.74) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL315787 0.78 HTR1A (0.56) RAB9AHTR1AHTR1DHTR1BSMN1; SMN2
SCHEMBL14417946 0.77 KDM4E (0.72) P2RX4ALDH1A1
SCHEMBL316060 0.75 CA12 (0.57) RAB9ASMN1; SMN2ALDH1A1DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2234992-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-10-06 EP claimed
US-20090281087-A1 Compounds II BIOVITRUM AB (SE) 2009-11-12 US claimed
WO-2009071668-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS BIOVITRUM AB (PUBL) (SE) 2009-06-11 WO claimed
EP-2234992-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2012-02-22 EP disclosed
US-8093248-B2 Compounds useful for the treatment of conditions associated with weight gain ASTRAZENECA AB (PUBL) (SE) 2012-01-10 US disclosed
EP-2234992-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS AstraZeneca AB (SE) 2010-10-06 EP disclosed
US-20090281087-A1 Compounds II BIOVITRUM AB (SE) 2009-11-12 US disclosed
WO-2009071668-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS BIOVITRUM AB (PUBL) (SE) 2009-06-11 WO 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
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 (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-20080064706-A1 Piperidine Derivatives as Histamine H3 Receptor Ligands HRH3, HRH1, HRH4 P2RX4 246/4885RAB9A 1386/4885HTR1A 6/4885
US-20090281087-A1 Compounds II GPR119, FABP4, LIPC P2RX4 2656/4885RAB9A 4549/4885HTR1A 1680/4885

“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.