SCHEMBL4993263

SCHEMBL4993263

c1ccc(N2CCN(c3cncc(-c4ccc5ccccc5c4)n3)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
NFKB1 P19838 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
PIM2 Q9P1W9 6/20 0.45
ROCK2 O75116 1/20 0.45
ROCK1 Q13464 1/20 0.45
CSNK1D P48730 4/20 0.43
MAPK11 Q15759 4/20 0.43
MAPK14 Q16539 4/20 0.43
LMNA P02545 2/20 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
SCHEMBL4995140 0.92 CSNK1D (0.49) CYP11B1CYP11B2PIM2ROCK2ROCK1
SCHEMBL5003429 0.90 KDM4E (0.51) MAPTNPC1RAB9ACYP11B1CYP11B2
SCHEMBL4996961 0.90 MEN1 (0.51) MAPTNPC1RAB9ACYP11B1CYP11B2
SCHEMBL4994785 0.88 SLC6A2 (0.47) MAPTALDH1A1GAASMN1; SMN2PIM2
SCHEMBL4997588 0.87 PIM2 (0.52) MAPTALDH1A1HTTSMN1; SMN2CYP11B1
SCHEMBL4997668 0.87 NPC1 (0.58) MAPTNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL4993281 0.86 MAPT (0.54) MAPTNPC1ALDH1A1GAAHPGD
SCHEMBL5003394 0.85 HTR3A (0.44) NPC1CYP11B1CYP11B2PIM2ROCK2
SCHEMBL4994089 0.85 NPSR1 (0.47) MAPTALDH1A1SMN1; SMN2PIM2LMNA
SCHEMBL4992059 0.84 POLB (0.51) MAPTNPC1ALDH1A1HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases AXXIMA PHARMACEUTICALS AG (DE) 2008-08-14 US claimed

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-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases PRNP, PSEN1, PPP5C MAPT 5/4885NPC1 2008/4885ALDH1A1 1034/4885

“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.