SCHEMBL3056252

SCHEMBL3056252

CCS(=O)(=O)c1ccc(-c2ccc(CN3CCN(C(C)C)CC3)nc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.47
PIK3CD O00329 3/20 0.42
PIK3R1 P27986 3/20 0.42
PIK3CA P42336 3/20 0.42
PIK3CB P42338 3/20 0.42
PIK3CG P48736 3/20 0.42
ENPP2 Q13822 1/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SYK P43405 1/20 0.36
DDR1 Q08345 3/20 0.35
JAK2 O60674 1/20 0.35
GABRA2 P47869 1/20 0.35

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
Hydrochloric Acid SCHEMBL27786221 0.99 HRH3 (0.47) HRH3PIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL3051677 0.82 PARP1 (0.39) HRH3LMNAGAAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL27786254 0.81 PARP1 (0.39) HRH3LMNAGAAKDM4EALDH1A1
SCHEMBL3056229 0.81 KDM2B (0.41) DDR1GABRA2
Hydrochloric Acid SCHEMBL27786263 0.80 KDM2B (0.40) DDR1GABRA2
SCHEMBL3051776 0.79 HRH3 (0.48) HRH3PIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL3066932 0.79 HRH3 (0.57) HRH3
Hydrochloric Acid SCHEMBL27786213 0.78 HRH3 (0.47) HRH3PIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL3055815 0.78 HRH3 (0.47) HRH3PIK3CDPIK3R1PIK3CAPIK3CB
Hydrochloric Acid SCHEMBL28944904 0.78 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 14 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
CN-101795567-A New heteocyclic H3 antagonists HIGH POINT PHARMACEUTICALS LLC 2010-08-04 CN 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
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
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 1/4885PIK3CD 4112/4885PIK3R1 1804/4885

“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.