SCHEMBL4249570

SCHEMBL4249570

Cc1cc(CNCCN2CCN(c3ccccc3)CC2)nn1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.47
CACNA1G O43497 2/20 0.47
DRD2 P14416 4/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
KCNH2 Q12809 2/20 0.44
HTR7 P34969 1/20 0.44
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
DRD4 P21917 2/20 0.43
GFER P55789 1/20 0.43
DRD3 P35462 1/20 0.43
SMO Q99835 1/20 0.43
HTR1A P08908 2/20 0.42

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
SCHEMBL5009526 0.94 DRD2 (0.53) SIGMAR1CACNA1GDRD2ALDH1A1LMNA
SCHEMBL4251582 0.92 CACNA1G (0.51) SIGMAR1CACNA1GDRD2ALDH1A1KDM4E
SCHEMBL4255387 0.90 ALDH1A1 (0.59) SIGMAR1CACNA1GALDH1A1MEN1KMT2A
SCHEMBL4250699 0.90 MAPT (0.51) DRD2ALDH1A1MEN1KMT2AHTR7
SCHEMBL4249518 0.88 ADRA1A (0.44) CACNA1GDRD2KDM4EKMT2AHTR7
SCHEMBL4246044 0.87 CACNA1G (0.53) CACNA1GDRD2MEN1KMT2AHTR7
SCHEMBL4248244 0.87 CACNA1G (0.51) CACNA1GDRD2ALDH1A1MEN1KMT2A
SCHEMBL4247744 0.85 CACNA1G (0.48) CACNA1GALDH1A1HSD17B10KDM4EMEN1
SCHEMBL4253426 0.85 CACNA1G (0.54) SIGMAR1CACNA1GDRD2HTR1A
SCHEMBL4249382 0.85 CACNA1G (0.48) SIGMAR1CACNA1GDRD2KCNH2HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1757590-B1 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof KOREA INST SCI & TECH (KR) 2009-12-02 EP claimed
US-7544686-B2 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-06-09 US claimed
US-20070049604-A1 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2007-03-01 US claimed
EP-1757590-A1 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof Korea Institute of Science and Technology (KR) 2007-02-28 EP claimed
EP-1757590-B1 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof KOREA INST SCI & TECH (KR) 2009-12-02 EP disclosed
US-7544686-B2 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-06-09 US disclosed
US-20070049604-A1 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2007-03-01 US disclosed
EP-1757590-A1 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof Korea Institute of Science and Technology (KR) 2007-02-28 EP 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-20070049604-A1 Piperazinylalkylpyrazole derivatives useful as selective T-type calcium channel blockers and preparation method thereof CACNA1I, CACNA1G, CACNA1H SIGMAR1 1029/4885CACNA1G 2/4885DRD2 1498/4885

“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.