SCHEMBL174707

SCHEMBL174707

Cc1nn(C)c(-c2ccc(F)cc2Cl)c1Nc1c(F)cc(C#N)cc1F

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC34A1 Q06495 9/20 0.39
HSD11B1 P28845 2/20 0.38
IGF1R P08069 2/20 0.37
DHODH Q02127 1/20 0.36
AR P10275 1/20 0.34
P2RX7 Q99572 1/20 0.34
CRHR1 P34998 1/20 0.34

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
SCHEMBL1724972 0.85 SLC34A1 (0.38) SLC34A1HSD11B1IGF1RDHODHAR
SCHEMBL174040 0.80 MAPK1 (0.45) SLC34A1HSD11B1IGF1RP2RX7
SCHEMBL14990088 0.78 CYP1A2 (0.42) SLC34A1HSD11B1IGF1RCRHR1
SCHEMBL175200 0.76 HSD11B1 (0.40) SLC34A1HSD11B1IGF1RP2RX7
SCHEMBL175196 0.76 CRHR1 (0.42) HSD11B1IGF1RCRHR1
SCHEMBL171014 0.75 EGLN2 (0.36) SLC34A1ARP2RX7
SCHEMBL173677 0.74 HSD11B1 (0.40) SLC34A1HSD11B1IGF1RP2RX7
SCHEMBL29368805 0.74 HSD11B1 (0.40) SLC34A1HSD11B1IGF1RP2RX7
SCHEMBL174763 0.74 P2RX7 (0.45) HSD11B1IGF1RP2RX7
SCHEMBL173769 0.74 HSD11B1 (0.36) HSD11B1ARP2RX7

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 13 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 claimed
EP-2611297-B1 FUNGICIDAL PYRAZOLES DU PONT (US) 2015-06-17 EP claimed
US-20140221448-A1 FUNGICIDAL PYRAZOLES E I DU PONT DE NEMOURS AND COMPANY (US) 2014-08-07 US claimed
EP-2611297-A1 FUNGICIDAL PYRAZOLES E.I. Du Pont De Nemours And Company (US) 2013-07-10 EP claimed
US-20130143940-A1 FUNGICIDAL PYRAZOLES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-06-06 US claimed
WO-2012030922-A1 FUNGICIDAL PYRAZOLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-03-08 WO claimed
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 SLC34A1 2543/4885HSD11B1 886/4885IGF1R 2269/4885
US-20130143940-A1 FUNGICIDAL PYRAZOLES CYP1A1, CYP1B1, CYP4X1 SLC34A1 2543/4885HSD11B1 886/4885IGF1R 2269/4885

“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.