SCHEMBL3066036

SCHEMBL3066036

CC(C)N1CCC(c2ccc(-c3ccc(C(=O)N(C)C)cc3)cn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.45
KDM5A P29375 1/20 0.41
CSNK2A1 P68400 1/20 0.40
CYP1A2 P05177 4/20 0.39
CLK4 Q9HAZ1 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP11B2 P19099 1/20 0.39
TSHR P16473 3/20 0.39
CYP2D6 P10635 2/20 0.39
CYP3A4 P08684 2/20 0.39
USP2 O75604 2/20 0.39
ATR Q13535 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
PDE9A O76083 1/20 0.38
BMPR1B O00238 1/20 0.38
BMPR1A P36894 1/20 0.38
TGFBR1 P36897 1/20 0.38
ACVRL1 P37023 1/20 0.38

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
SCHEMBL3067206 0.88 USP30 (0.46) HRH3KDM5ACYP3A4
SCHEMBL3072166 0.88 HRH3 (0.44) HRH3KDM5AALDH1A1GPR119
SCHEMBL3065770 0.83 CHRNA7 (0.50) HRH3KDM5AALDH1A1TSHR
SCHEMBL3060868 0.83 KDM2B (0.43) HRH3KDM5ACSNK2A1CYP1A2CLK4
SCHEMBL3061698 0.81 HRH3 (0.50) HRH3KDM5ACYP2C9BMPR1BBMPR1A
SCHEMBL13955444 0.79 HRH3 (0.40) HRH3KDM5AALDH1A1HSD17B10BMPR1B
SCHEMBL1744098 0.79 HRH3 (0.60) HRH3CYP1A2CLK4TSHRCYP2D6
SCHEMBL3056018 0.76 HRH3 (0.56) HRH3CSNK2A1ALDH1A1TSHRKCNH2
SCHEMBL3063437 0.75 PTGS1 (0.39) HRH3KDM5ABMPR1BBMPR1ATGFBR1
SCHEMBL3066025 0.74 PIK3CA (0.46) HRH3ALDH1A1BMPR1BBMPR1ATGFBR1

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
US-8344001-B2 Heterocyclic H3 antagonists HIGH POINT PHARMACEUTICALS, LLC (US) 2013-01-01 US claimed
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-8344001-B2 Heterocyclic H3 antagonists HIGH POINT PHARMACEUTICALS, LLC (US) 2013-01-01 US disclosed
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
US-20100267721-A1 Heterocyclic H3 Antagonists HIGH POINT PHARMACEUTICALS LLC (US) 2010-10-21 US disclosed
US-20100267721-A1 Heterocyclic H3 Antagonists HIGH POINT PHARMACEUTICALS LLC (US) 2010-10-21 US disclosed
EP-2014656-A2 New heteocyclic h3 antagonists TRANSTECH PHARMA (US) 2009-01-14 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 1/4885KDM5A 2422/4885CSNK2A1 944/4885

“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.