SCHEMBL7688652

SCHEMBL7688652

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.38
HTR5A P47898 1/20 0.34
SMO Q99835 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
DHODH Q02127 2/20 0.34
ADCY10 Q96PN6 1/20 0.34
FPR2 P25090 1/20 0.34
PROKR1 Q8TCW9 1/20 0.34
CHRM4 P08173 1/20 0.34
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
PABPC1 P11940 1/20 0.33
KMT2A Q03164 1/20 0.33
PPARG P37231 1/20 0.33
XIAP P98170 1/20 0.33
BIRC2 Q13490 1/20 0.33
PDE2A O00408 1/20 0.33
TTR P02766 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
SCHEMBL7688642 0.89 GRM5 (0.36) GRM5HTR5ASMOHPGDHTT
SCHEMBL7687213 0.88 HTR5A (0.38) GRM5HTR5ASMOHPGDHTT
SCHEMBL7910781 0.86 GRM5 (0.39) GRM5SMOADCY10FPR2PROKR1
SCHEMBL7687095 0.84 S1PR1 (0.44) LMNAKMT2A
SCHEMBL7684696 0.76 S1PR1 (0.44) LMNAKMT2A
SCHEMBL7904400 0.76 SMO (0.39) GRM5SMOHPGDHTTHSD17B10
SCHEMBL7687299 0.75 GRM5 (0.35) GRM5SMOHPGDHTTHSD17B10
SCHEMBL7690463 0.74 TGFBR1 (0.34) GRM5SMOHPGDHTTHSD17B10
SCHEMBL27532004 0.74 GRM5 (0.33) GRM5SMOHPGDHTTHSD17B10
SCHEMBL27676266 0.73 CYP1A2 (0.45) GRM5HPGDHSD17B10DHODHLMNA

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 6 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
CN-1237166-A Pyrazole derivatives useful as herbicides NOVARTIS AG (CH) 1999-12-01 CN disclosed
WO-1998042698-A1 PYRAZOLE DERIVATIVES AS HERBICIDES NOVARTIS AG (CH) 1998-10-01 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 GRM5 1578/4885HTR5A 1650/4885SMO 3742/4885

“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.