SCHEMBL4423239

SCHEMBL4423239

O=C(CCn1cnc(-c2ccccc2)c1)N1CCN(Cc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 3/20 0.57
FAAH O00519 1/20 0.52
SIGMAR1 Q99720 3/20 0.50
HTR7 P34969 6/20 0.49
HTT P42858 2/20 0.47
HTR1A P08908 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 1/20 0.45

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
SCHEMBL4422101 0.91 HTR7 (0.56) CACNA1GFAAHHTR7HTR1AMEN1
SCHEMBL4425296 0.91 HTR7 (0.57) HTR7HTTHTR1AMEN1KMT2A
SCHEMBL4419768 0.88 HTR7 (0.50) FAAHHTR7HTR1AMEN1KMT2A
SCHEMBL4418590 0.87 HTT (0.53) CACNA1GFAAHSIGMAR1HTR7HTT
SCHEMBL4417078 0.85 CACNA1G (0.52) CACNA1GFAAHSIGMAR1HTR7HTT
SCHEMBL4415388 0.81 ALDH1A1 (0.52) HTR7HTTHTR1AMEN1KMT2A
SCHEMBL4419917 0.81 TSHR (0.54) SIGMAR1HTR7HTTHTR1A
SCHEMBL4430505 0.81 TSHR (0.52) HTR7HTTHTR1AKMT2A
SCHEMBL4417940 0.80 CACNA1G (0.56) CACNA1GFAAHSIGMAR1HTR7HTT
SCHEMBL4413980 0.78 HTR1A (0.59) HTR7HTTHTR1AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CACNA1G 6/4885FAAH 1217/4885SIGMAR1 1748/4885

“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.