SCHEMBL4417664

SCHEMBL4417664

Cc1nccn1CCC(=O)NCCN1CCN(Cc2ccc(F)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.47
NAMPT P43490 1/20 0.45
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 1/20 0.44
FAAH O00519 5/20 0.44
ACHE P22303 5/20 0.44
BCHE P06276 2/20 0.43
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43

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
SCHEMBL4422458 0.91 KMT2A (0.54) MAPK1USP2LMNATSHRHTT
SCHEMBL4426748 0.88 ACHE (0.58) ALDH1A1KMT2AFAAHACHEBCHE
SCHEMBL4425649 0.88 LMNA (0.52) USP2LMNATSHRALDH1A1KMT2A
SCHEMBL4416082 0.87 CCR3 (0.51) MAPK1USP2LMNATSHRHTT
SCHEMBL4419759 0.86 ACHE (0.50) MAPK1USP2LMNATSHRHTT
SCHEMBL4415443 0.85 F10 (0.49) LMNAKMT2AHTR7
SCHEMBL4423053 0.80 POLB (0.56) MAPK1LMNATSHRHTTALDH1A1
SCHEMBL4422243 0.80 MAPK1 (0.47) MAPK1USP2LMNATSHRHTT
SCHEMBL4420407 0.79 ALDH1A1 (0.50) TSHRALDH1A1KMT2AHTR1AHTR7
SCHEMBL4423130 0.78 ACHE (0.57) MAPK1USP2LMNATSHRHTT

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 MAPK1 3177/4885NAMPT 2588/4885USP2 3594/4885

“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.