SCHEMBL945312

SCHEMBL945312

CC(C)(C)[Si](C)(C)OC1CCC(Nc2ccc(OC(F)(F)F)c(C(F)(F)F)c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.40
ULK1 O75385 1/20 0.39
ULK2 Q8IYT8 1/20 0.39
CNR1 P21554 4/20 0.38
EPHX2 P34913 1/20 0.38
PIM1 P11309 5/20 0.36
AR P10275 4/20 0.36
DYRK3 O43781 1/20 0.35
MAP4K4 O95819 1/20 0.35
ERBB2 P04626 1/20 0.35
MARK3 P27448 1/20 0.35
PLK1 P53350 1/20 0.35
CAMK2B Q13554 1/20 0.35
CDC42BPA Q5VT25 1/20 0.35
PIM3 Q86V86 1/20 0.35
MINK1 Q8N4C8 1/20 0.35
SRPK1 Q96SB4 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
MAP3K20 Q9NYL2 1/20 0.35
MAP4K5 Q9Y4K4 1/20 0.35

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
SCHEMBL12916453 0.89 PIM1 (0.38) ULK1ULK2EPHX2PIM1
SCHEMBL15354091 0.88 CNR2 (0.40) CNR2ULK1ULK2CNR1EPHX2
SCHEMBL944655 0.85 EPHX2 (0.45) CNR2CNR1EPHX2
SCHEMBL27796249 0.78 CNR2 (0.46) CNR2ULK1ULK2CNR1EPHX2
SCHEMBL945211 0.78 PIM1 (0.44) CNR2ULK1ULK2CNR1EPHX2
SCHEMBL27796248 0.78 CNR2 (0.46) CNR2ULK1ULK2CNR1EPHX2
SCHEMBL945213 0.78 PIM1 (0.44) CNR2ULK1ULK2CNR1EPHX2
SCHEMBL945523 0.78 PIM1 (0.44) CNR2ULK1ULK2CNR1EPHX2
SCHEMBL15850035 0.77 CNR2 (0.49) CNR2ULK1ULK2CNR1EPHX2
SCHEMBL945614 0.74 TRPV1 (0.34) PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2234973-B1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INT BV (NL) 2014-07-02 EP disclosed
EP-2234973-B1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INT BV (NL) 2014-07-02 EP disclosed
US-8569495-B2 Anthelmintic agents and their use INTERVET INTERNATIONAL B.V. (NL) 2013-10-29 US disclosed
US-8569495-B2 Anthelmintic agents and their use INTERVET INTERNATIONAL B.V. (NL) 2013-10-29 US disclosed
US-20110021506-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2011-01-27 US disclosed
EP-2234973-A1 ANTHELMINTIC AGENTS AND THEIR USE Intervet International B.V. (NL) 2010-10-06 EP disclosed
WO-2009077527-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2009-06-25 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-20110021506-A1 ANTHELMINTIC AGENTS AND THEIR USE ACHE, ABCB11, MPO CNR2 1257/4885ULK1 3453/4885ULK2 3641/4885

“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.