SCHEMBL1313380

SCHEMBL1313380

CCN1CCN(C(=O)OCc2ccncc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
LMNA P02545 1/20 0.51
HRH2 P25021 1/20 0.50
HRH1 P35367 1/20 0.50
GRIN2B Q13224 3/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
TMEM97 Q5BJF2 2/20 0.47
SIGMAR1 Q99720 2/20 0.47
NPSR1 Q6W5P4 1/20 0.46
GPR119 Q8TDV5 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
HSD11B1 P28845 1/20 0.44
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44

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
Formic Acid SCHEMBL1313560 0.95 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ALMNAHRH2
SCHEMBL10243152 0.85 MEN1 (0.62) ALDH1A1MEN1KMT2ATMEM97SIGMAR1
SCHEMBL13150170 0.82 KDM4E (0.60) ALDH1A1MEN1KMT2ALMNAGRIN2B
SCHEMBL15688093 0.81 TMEM97 (0.60) ALDH1A1MEN1KMT2ATMEM97SIGMAR1
SCHEMBL1314311 0.79 MEN1 (0.71) ALDH1A1MEN1KMT2ALMNAGRIN2B
SCHEMBL1312424 0.79 MAPT (0.46) ALDH1A1MEN1KMT2ALMNATMEM97
SCHEMBL1312780 0.79 FNTA (0.49) ALDH1A1MEN1KMT2ALMNAGRIN2B
Hydrochloric Acid SCHEMBL1313138 0.78 MEN1 (0.69) ALDH1A1MEN1KMT2ALMNAGRIN2B
Hydrochloric Acid SCHEMBL1312266 0.78 ALDH1A1 (0.45) ALDH1A1MEN1KMT2ALMNATMEM97
SCHEMBL1313183 0.78 NPSR1 (0.57) ALDH1A1MEN1KMT2ALMNAHRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110275637-A1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-11-10 US claimed
US-20110275637-A1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-11-10 US disclosed
US-20110275637-A1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-11-10 US disclosed
US-20110275637-A1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-11-10 US disclosed
EP-2313096-A1 NEW COMPOUNDS V AstraZeneca AB (Publ) (SE) 2011-04-27 EP disclosed
WO-2009147211-A1 NEW COMPOUNDS V BIOVITRUM AB (PUBL) (SE) 2009-12-10 WO 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-20110275637-A1 PIPERAZINE DERIVATIVES AND THEIR USE AS LEPTIN RECEPTOR MODULATORS ADIPOR2, GPR119, ADIPOR1 ALDH1A1 1875/4885MEN1 3508/4885KMT2A 2294/4885

“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.