SCHEMBL3310669

SCHEMBL3310669

Cc1ccc(-c2c(C)nnc(OCC(F)(F)F)c2-c2c(F)cccc2Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 2/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
PTGES O14684 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PRNP P04156 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
ALDH1A1 P00352 2/20 0.33
RECQL P46063 1/20 0.33
PDE2A O00408 1/20 0.33
PDE10A Q9Y233 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 1/20 0.32
RORC P51449 2/20 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
SCHEMBL3311725 0.93 KDM4E (0.37) KDM4ENPSR1RXFP1PTGESMEN1
SCHEMBL3307467 0.81 SGK1 (0.35) PDE2APDE10ASGK1
SCHEMBL3312845 0.78 RXFP1 (0.42) KDM4ENPSR1RXFP1TP53GAA
SCHEMBL3311233 0.77 HTT (0.35) TP53MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13165374 0.74 NPC1 (0.44) KDM4ENPSR1RXFP1PTGESMEN1
SCHEMBL3311654 0.73 PTGES (0.39) KDM4ENPSR1RXFP1TP53GAA
SCHEMBL3311845 0.72 NPC1 (0.42) KDM4ENPSR1RXFP1PTGESMEN1
SCHEMBL2348112 0.71 NPC1 (0.41) KDM4ENPSR1RXFP1PTGESKMT2A
SCHEMBL3329110 0.70 LMNA (0.40) PTGESMEN1KMT2APDE2APDE10A
SCHEMBL1870901 0.67 PTGES (0.38) KDM4ENPSR1TP53GAAPTGES

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
US-20100113457-A1 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA CROP PROTECTION, INC. (US) 2010-05-06 US claimed
US-20100113457-A1 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA CROP PROTECTION, INC. (US) 2010-05-06 US disclosed
EP-2121629-A1 NOVEL PYRIDAZINE DERIVATIVES Syngeta Participations AG (CH) 2009-11-25 EP disclosed
WO-2008049584-A1 NOVEL PYRIDAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2008-05-02 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-20100113457-A1 NOVEL PYRIDAZINE DERIVATIVES C3AR1, C5, C1S KDM4E 3740/4885NPSR1 630/4885RXFP1 2667/4885

“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.