SCHEMBL4423233

SCHEMBL4423233

Cc1cn(CCC(=O)NCCN2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)cn1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.51
SIGMAR1 Q99720 3/20 0.48
HTT P42858 2/20 0.48
CACNA1G O43497 3/20 0.46
FAAH O00519 5/20 0.44
ACHE P22303 5/20 0.43
BCHE P06276 2/20 0.43
MAPT P10636 1/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL4419744 0.90 ACHE (0.52) HTTCACNA1GFAAHACHEBCHE
SCHEMBL4422243 0.87 MAPK1 (0.47) HTTFAAHACHEBCHE
SCHEMBL4416126 0.87 HTR1A (0.56) HTTFAAHACHEBCHEALDH1A1
SCHEMBL4417078 0.86 CACNA1G (0.52) SIGMAR1HTTCACNA1GFAAHKDM4E
SCHEMBL4418590 0.86 HTT (0.53) CCR3SIGMAR1HTTCACNA1GFAAH
SCHEMBL4413983 0.85 ACHE (0.58) FAAHACHEBCHEALDH1A1SMN1; SMN2
SCHEMBL4416082 0.81 CCR3 (0.51) CCR3SIGMAR1HTTCACNA1GFAAH
SCHEMBL4422240 0.79 LMNA (0.57) MAPTALDH1A1SMN1; SMN2
SCHEMBL4420419 0.77 HSD17B10 (0.50) MAPTALDH1A1SMN1; SMN2
SCHEMBL4419772 0.76 TSHR (0.57) HTTFAAHACHEBCHEMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US claimed
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 US claimed
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US disclosed
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 US 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-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF CACNA1B, CACNA1C, ORAI1 CCR3 4196/4885SIGMAR1 1748/4885HTT 2680/4885

“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.