SCHEMBL313838

SCHEMBL313838

Cc1ccc(N2CCN(C(=O)NC3CCN(C)CC3)CC2)cc1C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
GFER P55789 2/20 0.52
GAA P10253 1/20 0.51
DRD2 P14416 1/20 0.50
DRD3 P35462 1/20 0.50
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
KMT2A Q03164 1/20 0.45
USP30 Q70CQ3 1/20 0.45
HPGDS O60760 3/20 0.44
HRH3 Q9Y5N1 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
SCHEMBL316060 0.84 CA12 (0.57) MAPTSMN1; SMN2GFERDRD2DRD3
SCHEMBL314521 0.82 MAPT (0.58) MAPTSMN1; SMN2GFERKDM4EKMT2A
SCHEMBL315787 0.79 HTR1A (0.56) MAPTSMN1; SMN2RAB9AALDH1A1KMT2A
SCHEMBL5468425 0.78 MAPT (0.74) MAPTSMN1; SMN2GFERGAARAB9A
SCHEMBL314293 0.78 SIRT6 (0.60) MAPTSMN1; SMN2GFERALDH1A1KMT2A
SCHEMBL14417946 0.76 KDM4E (0.72) ALDH1A1KDM4E
SCHEMBL8320347 0.74 ADRB1 (0.63) MAPTSMN1; SMN2GFERGAARAB9A
SCHEMBL314528 0.73 P2RX4 (0.55) SMN1; SMN2GAADRD2DRD3RAB9A
SCHEMBL314504 0.73 GAA (0.68) SMN1; SMN2GAARAB9AALDH1A1KDM4E
SCHEMBL2021224 0.73 MAPT (0.66) MAPTSMN1; SMN2GFERGAARAB9A

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 MAPT 2304/4885SMN1; SMN2 4046/4885GFER 3998/4885
US-20090281087-A1 Compounds II GPR119, FABP4, LIPC MAPT 4470/4885SMN1; SMN2 4356/4885GFER 3935/4885

“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.