SCHEMBL6183941

SCHEMBL6183941

CSc1nc(-n2ccc(C(F)(F)F)n2)ncc1C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.42
IDH1 O75874 13/20 0.41
IDH2 P48735 1/20 0.41
NPC1 O15118 2/20 0.34
MAPT P10636 2/20 0.34
BCL6 P41182 1/20 0.33
MBOAT4 Q96T53 1/20 0.33
RAB9A P51151 1/20 0.32
POLB P06746 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
SCHEMBL6182361 0.77 PRMT6 (0.41) PRMT6IDH1IDH2NPC1MAPT
SCHEMBL7877675 0.72 GABRA1 (0.37) PRMT6IDH1IDH2NPC1MAPT
SCHEMBL13719550 0.71 IDH1 (0.44) PRMT6IDH1IDH2NPC1MAPT
SCHEMBL8131650 0.70 PRMT6 (0.42) PRMT6IDH1IDH2NPC1MAPT
SCHEMBL13719485 0.70 IDH1 (0.51) PRMT6IDH1IDH2NPC1MAPT
SCHEMBL5209985 0.69 HSP90AA1 (0.39) PRMT6IDH1IDH2MAPTRAB9A
SCHEMBL5206965 0.69 CNR2 (0.47) NPC1MAPTRAB9A
SCHEMBL7873623 0.69 ALDH1A1 (0.44) MAPTPOLB
SCHEMBL6723685 0.69 PRMT6 (0.37) PRMT6IDH1IDH2NPC1MAPT
SCHEMBL12531812 0.68 IDH1 (0.43) PRMT6IDH1IDH2NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1421080-B1 N-HETEROCYCLYL SUBSTITUTED THIENYLOXY-PYRIMIDINES USED AS HERBICIDES BASF AG (DE) 2005-02-09 EP disclosed
US-20040198758-A1 N-heterocyclyl substituted thienyloxy-pyrimidines used as herbicides BASF AKTIENGESELLSCHAFT (DE) 2004-10-07 US disclosed
US-6172005-B1 CONTROLLING UNDESIRABLE VEGETATION E. I. DU PONT DE NEMOURS AND COMPANY 2001-01-09 US disclosed
EP-0970072-A1 HETEROARYL AZOLE HERBICIDES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2000-01-12 EP disclosed
WO-1998040379-A1 HETEROARYL AZOLE HERBICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-09-17 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-20040198758-A1 N-heterocyclyl substituted thienyloxy-pyrimidines used as herbicides CBR3, CBR1, CBX8 PRMT6 2296/4885IDH1 214/4885IDH2 361/4885

“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.