SCHEMBL4908801

SCHEMBL4908801

Cc1cc(C)n(-c2nc(NC3CCCCC3)c3ccccc3n2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN2 Q9H2S1 1/20 0.59
KCNN3 Q9UGI6 1/20 0.59
CCR4 P51679 1/20 0.56
PDE5A O76074 2/20 0.53
ACP1 P24666 2/20 0.53
OGG1 O15527 1/20 0.53
ALDH1A1 P00352 2/20 0.52
TLR7 Q9NYK1 2/20 0.51
LMNA P02545 2/20 0.51
NR2F2 P24468 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
S1PR2 O95136 1/20 0.51
XBP1 P17861 1/20 0.51
RAB9A P51151 1/20 0.51
PPP1CA P62136 1/20 0.51
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL4912379 1.00 KCNN2 (0.59) KCNN2KCNN3CCR4PDE5AACP1
SCHEMBL4913903 1.00 KCNN2 (0.59) KCNN2KCNN3CCR4PDE5AACP1
SCHEMBL4911365 0.99 KCNN2 (0.57) KCNN2KCNN3CCR4PDE5AACP1
SCHEMBL4910336 0.94 ALDH1A1 (0.51) KCNN2KCNN3CCR4PDE5AACP1
SCHEMBL4913809 0.90 ALDH1A1 (0.51) KCNN2KCNN3CCR4ACP1ALDH1A1
SCHEMBL4913744 0.89 KDM4E (0.48) KCNN2KCNN3CCR4ACP1ALDH1A1
SCHEMBL4911767 0.89 CYP1A2 (0.55) KCNN2KCNN3CCR4ALDH1A1LMNA
SCHEMBL4913314 0.87 MAPK1 (0.45) KCNN2KCNN3CCR4ACP1ALDH1A1
SCHEMBL4913876 0.86 GBA1 (0.55) KCNN2KCNN3ALDH1A1NPSR1KMT2A
SCHEMBL22872865 0.84 KCNN2 (0.56) KCNN2KCNN3CCR4ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1861388-B1 POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE SANIONA AS (DK) 2017-07-05 EP claimed
US-8252806-B2 2-(3,5-Dimethyl-pyrazol-1-yl)-quinazolin-4-yl]-propylamine; 2-(3,5-Dimethyl-pyrazol-1-yl)-quinazolin-4-yl]-(4-morpholin-4-yl-phenyl)-amine; respiratory diseases, epilepsy, convulsions, seizures, gastrointestinal dysfunction, ischaemia, psychosis, schizophrenia, anxiety, depression, Alzheimer's disease NEUROSEARCH A/S (DK) 2012-08-28 US claimed
US-20080275045-A1 Potassium Channel Modulating Agents and Their Medical Use NEUROSEARCH A/S (DK) 2008-11-06 US claimed
CN-101115736-A Potassium channel modulating agents and their medical use NEUROSEARCH AS (DK) 2008-01-30 CN claimed
EP-1861388-A1 POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE NeuroSearch A/S (DK) 2007-12-05 EP claimed
WO-2006097441-A1 POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2006-09-21 WO claimed
EP-1861388-B1 POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE SANIONA AS (DK) 2017-07-05 EP disclosed
US-8252806-B2 2-(3,5-Dimethyl-pyrazol-1-yl)-quinazolin-4-yl]-propylamine; 2-(3,5-Dimethyl-pyrazol-1-yl)-quinazolin-4-yl]-(4-morpholin-4-yl-phenyl)-amine; respiratory diseases, epilepsy, convulsions, seizures, gastrointestinal dysfunction, ischaemia, psychosis, schizophrenia, anxiety, depression, Alzheimer's disease NEUROSEARCH A/S (DK) 2012-08-28 US disclosed
US-20080275045-A1 Potassium Channel Modulating Agents and Their Medical Use NEUROSEARCH A/S (DK) 2008-11-06 US disclosed
CN-101115736-A Potassium channel modulating agents and their medical use NEUROSEARCH AS (DK) 2008-01-30 CN disclosed
EP-1861388-A1 POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE NeuroSearch A/S (DK) 2007-12-05 EP disclosed
WO-2006097441-A1 POTASSIUM CHANNEL MODULATING AGENTS AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2006-09-21 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-20080275045-A1 Potassium Channel Modulating Agents and Their Medical Use KCND2, KCNN3, KCNJ2 KCNN2 4/4885KCNN3 2/4885CCR4 3341/4885

“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.