SCHEMBL5202284

SCHEMBL5202284

FC(F)(F)c1cnc(CN=C(c2ccccc2)c2ccccc2)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 0.53
HPGD P15428 1/20 0.53
KMT2A Q03164 3/20 0.53
NPSR1 Q6W5P4 2/20 0.49
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.47
GAA P10253 2/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 1/20 0.46
CYP2C9 P11712 3/20 0.46
CYP2C19 P33261 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HTT P42858 2/20 0.44
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
MAPK1 P28482 1/20 0.43

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
Hydrochloric Acid SCHEMBL6157615 0.78 GRIN2B (0.48) GLAHPGDKMT2ATDP1L3MBTL1
SCHEMBL784586 0.77 GLA (0.62) GLAHPGDKMT2ANPSR1MRGPRX4
SCHEMBL1722652 0.75 TDP1 (0.58) GLAKMT2ANPSR1TDP1L3MBTL1
SCHEMBL2310275 0.74 LMNA (0.59) GLAHPGDKMT2AMRGPRX4GAA
SCHEMBL4456238 0.73 GLA (0.65) GLAHPGDKMT2AMRGPRX4GAA
SCHEMBL6158006 0.72 KMT2A (0.41) GLAHPGDKMT2ANPSR1TDP1
SCHEMBL6158003 0.72 KMT2A (0.41) GLAHPGDKMT2ANPSR1TDP1
SCHEMBL5422033 0.71 GRIN2B (0.49) MAPT
SCHEMBL5200890 0.71 GLA (0.47) GLAHPGDKMT2ANPSR1MRGPRX4
SCHEMBL3208283 0.70 TDP1 (0.59) GLAKMT2ANPSR1TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1056723-B1 2-PYRIDYLMETHYLAMINE DERIVATIVES USEFUL AS FUNGICIDES BAYER CROPSCIENCE LTD (GB) 2007-11-28 EP disclosed
US-6828441-B2 Agriculture AVENTIS CROPSCIENCE UK LIMITED (GB) 2004-12-07 US disclosed
CN-1132816-C 2-pyridylmethylamine derivatives useful as fungicides AVENTIS CROPSCIENCE UK LTD. (GB) 2003-12-31 CN disclosed
US-20030171410-A1 2-pyridylmethylamine derivatives useful as fungicides AVENTIS CROPSCIENCE UK LIMITED 2003-09-11 US disclosed
US-6503933-B1 Combating phytopathogenic fungi AVENTIS CROPSCIENCE UK LIMITED (GB) 2003-01-07 US disclosed
CN-1291187-A 2-pyridylmethylamine derivatives useful as fungicides AGREVO UK LTD (GB) 2001-04-11 CN disclosed
EP-1056723-A1 2-PYRIDYLMETHYLAMINE DERIVATIVES USEFUL AS FUNGICIDES Aventis CropScience UK Limited (GB) 2000-12-06 EP disclosed
WO-1999042447-A1 2-PYRIDYLMETHYLAMINE DERIVATIVES USEFUL AS FUNGICIDES AVENTIS CROPSCIENCE UK LIMITED (GB) 1999-08-26 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-20030171410-A1 2-pyridylmethylamine derivatives useful as fungicides PNPO, ME1, CYP2S1 GLA 2862/4885HPGD 2280/4885KMT2A 407/4885

“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.