SCHEMBL7687213

SCHEMBL7687213

Cc1c(-c2ncc(Cl)cc2F)nn(C)c1C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 2/20 0.38
GRM5 P41594 3/20 0.38
GRM2 Q14416 1/20 0.37
CHRM4 P08173 1/20 0.35
JAK2 O60674 2/20 0.35
JAK1 P23458 2/20 0.35
MAP4K4 O95819 1/20 0.34
SMO Q99835 1/20 0.34
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP2C9 P11712 1/20 0.33
PKMYT1 Q99640 1/20 0.33
FPR2 P25090 1/20 0.33
PROKR1 Q8TCW9 1/20 0.33
TGFBR1 P36897 1/20 0.33
TGFBR2 P37173 1/20 0.33
TYK2 P29597 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL7688652 0.88 GRM5 (0.38) HTR5AGRM5CHRM4SMOHPGD
SCHEMBL7910781 0.85 GRM5 (0.39) GRM5CHRM4SMOFPR2PROKR1
SCHEMBL7687095 0.83 S1PR1 (0.44) LMNAKMT2A
SCHEMBL7688642 0.80 GRM5 (0.36) HTR5AGRM5CHRM4SMOHPGD
SCHEMBL7684696 0.75 S1PR1 (0.44) LMNAKMT2A
SCHEMBL7904400 0.75 SMO (0.39) GRM5SMOHPGDHTTHSD17B10
SCHEMBL7687299 0.74 GRM5 (0.35) GRM5SMOHPGDHTTHSD17B10
SCHEMBL7690463 0.73 TGFBR1 (0.34) GRM5SMOHPGDHTTHSD17B10
SCHEMBL27532004 0.73 GRM5 (0.33) GRM5SMOHPGDHTTHSD17B10
SCHEMBL7687973 0.72 MAPT (0.40) HTTTGFBR1KMT2A

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
US-20020055639-A1 Pyrazole derivatives as herbicides NEBEL KURT (CH) 2002-05-09 US disclosed
US-6274536-B1 CROPS, AGRICULTURE; PRE- AND POSTEMERGENCE SYNGENTA CROP PROTECTION, INC. 2001-08-14 US disclosed
US-6204221-B1 Herbicides SYNGENTA CROP PROTECTION, INC. 2001-03-20 US disclosed
EP-0966461-A1 PYRAZOLE DERIVATIVES AS HERBICIDES Novartis AG (CH) 1999-12-29 EP disclosed
EP-0941222-A2 PYRAZOLE DERIVATIVES USEFUL AS HERBICIDES Novartis AG (CH) 1999-09-15 EP disclosed
WO-1998042698-A1 PYRAZOLE DERIVATIVES AS HERBICIDES NOVARTIS AG (CH) 1998-10-01 WO disclosed
WO-1998021199-A2 PYRAZOLE DERIVATIVES USEFUL AS HERBICIDES NOVARTIS AG (CH) 1998-05-22 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-20020055639-A1 Pyrazole derivatives as herbicides CBR3, HCN1, HCN2 HTR5A 1650/4885GRM5 1578/4885GRM2 434/4885

“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.