SCHEMBL6427798

SCHEMBL6427798

CCC(C1CCCN1)N(c1ccc(OC)c(Cl)c1)c1nc(N)nc(NCc2cccs2)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 6/20 0.33
LMNA P02545 5/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
HTT P42858 1/20 0.32
DUSP3 P51452 1/20 0.32
PTPN5 P54829 1/20 0.32
PTPN11 Q06124 1/20 0.32
TP53 P04637 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
GCK P35557 1/20 0.31
GPX4 P36969 3/20 0.31

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
SCHEMBL6428837 0.91 ALDH1A1 (0.35) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6428076 0.82 POLB (0.33) MEN1KMT2ASMN1; SMN2GCKPOLB
SCHEMBL5412214 0.79 TACR1 (0.35) MAPTTACR1CYP2D6
SCHEMBL6428528 0.78 GALR1 (0.35)
SCHEMBL6819318 0.77 MAPK1 (0.33) MAPTALDH1A1SMN1; SMN2TP53TACR1
SCHEMBL5554034 0.77 GALR1 (0.38) MEN1KMT2ASMN1; SMN2ADORA2AADORA1
SCHEMBL6607370 0.77 GALR1 (0.39) MEN1KMT2ASMN1; SMN2ADORA2AADORA1
SCHEMBL5553512 0.76 MAPK1 (0.39)
SCHEMBL5553495 0.76 MAPK1 (0.34)
SCHEMBL6427795 0.76 DRD2 (0.36) MEN1KMT2AMAPTLMNAALDH1A1

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-20050124619-A1 Medical devices employing triazine compounds and compositions thereof DR. REDDY'S LABORATORIES LTD. (IN) 2005-06-09 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-20050124619-A1 Medical devices employing triazine compounds and compositions thereof PTGIS, AREG, TGFB1 MEN1 4510/4885KMT2A 3506/4885MAPT 3475/4885

“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.