SCHEMBL3389193

SCHEMBL3389193

CCc1nnc(-c2cccc(-c3nnc(CC)c(CC)n3)n2)nc1CC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.37
CCR8 P51685 2/20 0.37
MAPT P10636 4/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 3/20 0.31
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
TP53 P04637 2/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
ALPL P05186 1/20 0.30
HSP90AA1 P07900 1/20 0.30
ALPI P09923 1/20 0.30
ALPG P10696 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL3391256 0.91 CCR1 (0.52) CCR1CCR8MAPT
SCHEMBL3393079 0.82 KCNH2 (0.38) MAPTRAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL1944627 0.81 KCNH2 (0.32) CCR1CCR8MAPTMEN1KMT2A
SCHEMBL3389939 0.76 TRPM8 (0.41) HSD17B10ALDH1A1KDM4ESMN1; SMN2
SCHEMBL3391217 0.75 MEN1 (0.31) MEN1KMT2AL3MBTL1
SCHEMBL3390338 0.74 HSP90AA1 (0.49) CCR1CCR8MAPTRAB9ANPC1
SCHEMBL2506412 0.73 KDM4E (0.34) CCR1CCR8MEN1KMT2ARAB9A
SCHEMBL1948200 0.73 KDM4E (0.34) CCR1CCR8MEN1KMT2ARAB9A
SCHEMBL3388222 0.68 CCR1 (0.41) CCR1CCR8MAPTMEN1KMT2A
SCHEMBL3386564 0.68 SQOR (0.40) MAPTMEN1KMT2AHSD17B10ALDH1A1

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
EP-2010514-B1 3-(PYRIDIN-2-YL)-[1,2,4]-TRIAZINES FOR USE AS FUNGICIDES BASF SE (DE) 2010-12-29 EP claimed
US-20090111692-A1 3-(Pyridin-2-Yl)-[1,2,4]-Triazines as Fungicides BASF AKTIENGESELLSCHAFT (DE) 2009-04-30 US claimed
CN-102614683-B Method for separating element palladium and sub-actinide elements from high-level waste UNIV ZHEJIANG 2014-01-15 CN disclosed
EP-2010514-B1 3-(PYRIDIN-2-YL)-[1,2,4]-TRIAZINES FOR USE AS FUNGICIDES BASF SE (DE) 2010-12-29 EP 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-20090111692-A1 3-(Pyridin-2-Yl)-[1,2,4]-Triazines as Fungicides CBR3, CBR1, TH CCR1 131/4885CCR8 738/4885MAPT 4716/4885

“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.