SCHEMBL4994763

SCHEMBL4994763

Cc1cccc(-c2cncc(N3CCN(c4ccccc4F)CC3)n2)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 2/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 2/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
HSP90AA1 P07900 1/20 0.41
CNR2 P34972 1/20 0.41
HSD17B10 Q99714 1/20 0.40
CYP11B2 P19099 1/20 0.40
USP2 O75604 1/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 2/20 0.40

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
SCHEMBL4992085 0.92 MAPT (0.52) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL5002992 0.83 MAPT (0.51) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL4992184 0.80 MAPT (0.52) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL4992191 0.77 MAPT (0.54) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL4994571 0.76 SMN1; SMN2 (0.51) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL4997085 0.76 MAPT (0.48) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL4993013 0.76 RAF1 (0.49) MAPTSMN1; SMN2LMNANPSR1ALDH1A1
SCHEMBL5000713 0.75 LMNA (0.57) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL5003046 0.75 DRD2 (0.52) MAPTSMN1; SMN2LMNANFKB1NFKB2
SCHEMBL4996338 0.74 MAPT (0.49) MAPTSMN1; SMN2LMNANFKB1NFKB2

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 5/4885SMN1; SMN2 896/4885LMNA 2743/4885

“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.