SCHEMBL173503

SCHEMBL173503

Cc1nn(C)c(-c2ccc(F)cc2Cl)c1N

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.47
IGF1R P08069 2/20 0.39
SLC2A1 P11166 1/20 0.39
SCN10A Q9Y5Y9 1/20 0.39
P2RX7 Q99572 1/20 0.39
SLC34A1 Q06495 2/20 0.37
PDE2A O00408 2/20 0.37
PDE10A Q9Y233 2/20 0.37
PDE7A Q13946 1/20 0.37
DPP4 P27487 1/20 0.36
PDE6D O43924 1/20 0.36
PDE6A P16499 1/20 0.36
PDE6G P18545 1/20 0.36
PDE6B P35913 1/20 0.36
PDE6C P51160 1/20 0.36
PDE6H Q13956 1/20 0.36
NISCH Q9Y2I1 1/20 0.36
CRHR1 P34998 1/20 0.36
GRM2 Q14416 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
SCHEMBL173619 0.79 HSD11B1 (0.47) HSD11B1SCN10AP2RX7PDE2APDE10A
SCHEMBL29520229 0.79 HSD11B1 (0.47) HSD11B1SCN10AP2RX7PDE2APDE10A
SCHEMBL174691 0.78 P2RX7 (0.43) HSD11B1IGF1RSCN10AP2RX7GRM2
SCHEMBL174040 0.78 MAPK1 (0.45) HSD11B1IGF1RP2RX7SLC34A1PDE2A
SCHEMBL174924 0.77 LMNA (0.54) HSD11B1P2RX7
SCHEMBL174763 0.77 P2RX7 (0.45) HSD11B1IGF1RSCN10AP2RX7GRM2
SCHEMBL20698175 0.76 HSD11B1 (0.49) HSD11B1P2RX7PDE2APDE10APDE7A
SCHEMBL20680749 0.75 IGF1R (0.39) HSD11B1IGF1RPDE2APDE10APDE7A
SCHEMBL14990301 0.75 HSD11B1 (0.40) HSD11B1IGF1RSCN10AP2RX7SLC34A1
SCHEMBL175155 0.75 ALDH1A1 (0.44) HSD11B1IGF1RSCN10AP2RX7DPP4

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-9131693-B2 Fungicidal pyrazoles E I DU PONT DE NEMOURS AND COMPANY (US) 2015-09-15 US disclosed
EP-2611297-B1 FUNGICIDAL PYRAZOLES DU PONT (US) 2015-06-17 EP disclosed
US-20140221448-A1 FUNGICIDAL PYRAZOLES E I DU PONT DE NEMOURS AND COMPANY (US) 2014-08-07 US disclosed
US-8754115-B2 Fungicidal pyrazoles E I DU PONT DE NEMOURS AND COMPANY (US) 2014-06-17 US disclosed
EP-2611297-A1 FUNGICIDAL PYRAZOLES E.I. Du Pont De Nemours And Company (US) 2013-07-10 EP disclosed
US-20130143940-A1 FUNGICIDAL PYRAZOLES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-06-06 US disclosed
WO-2012030922-A1 FUNGICIDAL PYRAZOLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-03-08 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 (2 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-20140221448-A1 FUNGICIDAL PYRAZOLES CYP1A1, CYP1B1, CYP4X1 HSD11B1 886/4885IGF1R 2269/4885SLC2A1 3772/4885
US-20130143940-A1 FUNGICIDAL PYRAZOLES CYP1A1, CYP1B1, CYP4X1 HSD11B1 886/4885IGF1R 2269/4885SLC2A1 3772/4885

“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.