SCHEMBL314504

SCHEMBL314504

CN1CCC(NC(=O)N2CCN(c3ccccc3O)CC2)CC1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.68
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
P2RX4 Q99571 1/20 0.55
RAB9A P51151 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.52
CYP46A1 Q9Y6A2 1/20 0.49
HRH3 Q9Y5N1 3/20 0.48
EPHX2 P34913 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
DPP7 Q9UHL4 1/20 0.46
USP30 Q70CQ3 1/20 0.46

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
SCHEMBL314528 0.87 P2RX4 (0.55) GAAP2RX4RAB9ASMN1; SMN2CYP46A1
SCHEMBL4978037 0.84 RAB9A (0.52) GAAKMT2AMEN1P2RX4RAB9A
SCHEMBL314463 0.84 HTR1A (0.62) GAAP2RX4RAB9AKDM4EALDH1A1
SCHEMBL5470285 0.78 GAA (0.60) GAAKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL315787 0.78 HTR1A (0.56) KMT2AMEN1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14417946 0.77 KDM4E (0.72) P2RX4EPHX2KDM4EALDH1A1
SCHEMBL18389913 0.75 HTT (0.69) P2RX4KDM4EALDH1A1DPP7
SCHEMBL314521 0.75 MAPT (0.58) KMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL1308333 0.75 ADRA2C (0.60) GAAKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL316060 0.75 CA12 (0.57) RAB9ASMN1; SMN2ALDH1A1USP30

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 12 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
WO-2007119966-A9 RESIN COMPOSITION COMPRISING CATALYST PRECURSOR FOR ELECTROLESS PLATING TO FORM ELECTROMAGNETIC WAVE SHIELDING LAYER, METHODS FOR FORMING METAL PATTERNS USING THE RESIN COMPOSITION AND METAL PATTERNS FORMED BY THE METHODS LG CHEMICAL LTD (KR) 2008-10-02 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 GAA 3988/4885KMT2A 395/4885MEN1 3498/4885
US-20090281087-A1 Compounds II GPR119, FABP4, LIPC GAA 890/4885KMT2A 4074/4885MEN1 2136/4885

“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.