SCHEMBL4147980

SCHEMBL4147980

[c]1ccccc1NN1CCNCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.37
ADRB1 P08588 4/20 0.37
HTR3E A5X5Y0 4/20 0.37
HTR3B O95264 4/20 0.37
HTR3A P46098 4/20 0.37
HTR3D Q70Z44 4/20 0.37
HTR3C Q8WXA8 4/20 0.37
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 2/20 0.33
PLD1 Q13393 1/20 0.33
HTR5A P47898 3/20 0.32
HTR1A P08908 3/20 0.32
HTR7 P34969 3/20 0.32
HTR6 P50406 3/20 0.32
HTR2A P28223 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
NCF1 P14598 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL4152132 0.81 KDM1A (0.42) KMT2AMEN1POLBCYP1A2CYP2D6
SCHEMBL3759186 0.72 POLB (0.59) SIGMAR1POLBCYP1A2CYP2D6TSHR
SCHEMBL644787 0.71 POLB (0.49) SIGMAR1ADRB1HTR3EHTR3BHTR3A
SCHEMBL4147985 0.68 ADRB1 (0.32) SIGMAR1ADRB1HTR3EHTR3BHTR3A
SCHEMBL188699 0.68 ADRB1 (0.50) SIGMAR1ADRB1HTR3EHTR3BHTR3A
SCHEMBL2180525 0.67 ALDH1A1 (0.47) KMT2APOLBTSHRHSD17B10CYP2C19
SCHEMBL8722545 0.67 SLC6A4 (0.49) SIGMAR1HTR1ADRD2
SCHEMBL6626303 0.66 POLB (0.44) SIGMAR1ADRB1HTR3EHTR3BHTR3A
SCHEMBL1411653 0.65
SCHEMBL1055871 0.64 BPTF (0.52) KMT2AMEN1PLD1HTR1AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same YUYU PHARMA, INC. (KR) 2009-07-02 US claimed
EP-1984370-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Crystalgenomics, Inc. (KR) 2008-10-29 EP claimed
WO-2007083978-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME CRYSTALGENOMICS, INC. (KR) 2007-07-26 WO claimed
US-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same YUYU PHARMA, INC. (KR) 2009-07-02 US disclosed
EP-1984370-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Crystalgenomics, Inc. (KR) 2008-10-29 EP disclosed
WO-2007083978-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME CRYSTALGENOMICS, INC. (KR) 2007-07-26 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-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same GSK3B, GSK3A, MAP3K3 SIGMAR1 2489/4885ADRB1 1336/4885HTR3E 2089/4885

“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.