SCHEMBL3062019

SCHEMBL3062019

CC(C)N1CCN(Cc2ccc(-c3ccc(C4CN(C=O)CCO4)cc3)nn2)CC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.34
MOGAT2 Q3SYC2 2/20 0.34
PARP1 P09874 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
SLC16A3 O15427 5/20 0.33
KCNH2 Q12809 2/20 0.33
MGAT2 Q10469 1/20 0.33
CNR2 P34972 2/20 0.32
ACVR1 Q04771 1/20 0.32
ALK Q9UM73 1/20 0.32
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
DRD3 P35462 1/20 0.31
HTR2B P41595 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
GSK3B P49841 1/20 0.31
IL4I1 Q96RQ9 1/20 0.31

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
SCHEMBL1743085 0.84 ACACB (0.37) HRH3CYP1A2CYP2D6GSK3B
SCHEMBL3072063 0.76 HRH3 (0.36) HRH3PARP1PARP2SLC16A3ACVR1
SCHEMBL1744043 0.73 HDAC4 (0.39) HRH3ACVR1
SCHEMBL3051677 0.71 PARP1 (0.39) HRH3PARP1PARP2ALK
SCHEMBL3062013 0.70 HRH3 (0.63) HRH3
Hydrochloric Acid SCHEMBL27786254 0.70 PARP1 (0.39) HRH3PARP1PARP2ALK
SCHEMBL3062510 0.69 HRH3 (0.45) HRH3PARP1PARP2KCNH2
SCHEMBL3061612 0.69 PARP1 (0.38) HRH3PARP1PARP2ALKCYP1A2
SCHEMBL3072061 0.68 HRH3 (0.62) HRH3
SCHEMBL3057103 0.67 HRH3 (0.56) HRH3

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-20100267721-A1 Heterocyclic H3 Antagonists HIGH POINT PHARMACEUTICALS LLC (US) 2010-10-21 US claimed
US-8344001-B2 Heterocyclic H3 antagonists HIGH POINT PHARMACEUTICALS, LLC (US) 2013-01-01 US disclosed
US-20100267721-A1 Heterocyclic H3 Antagonists HIGH POINT PHARMACEUTICALS LLC (US) 2010-10-21 US disclosed
EP-2166850-A1 NEW HETEOCYCLIC H3 ANTAGONISTS High Point Pharmaceuticals, LLC (US) 2010-03-31 EP disclosed
EP-2014656-A2 New heteocyclic h3 antagonists TRANSTECH PHARMA (US) 2009-01-14 EP disclosed
WO-2008154126-A1 NEW HETEOCYCLIC H3 ANTAGONISTS HIGH POINT PHARMACEUTICALS, LLC (US) 2008-12-18 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-20100267721-A1 Heterocyclic H3 Antagonists HRH3, HRH4, HRH2 HRH3 1/4885MOGAT2 3402/4885PARP1 1812/4885

“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.