SCHEMBL173926

SCHEMBL173926

Cc1cccc(Cl)c1Nc1c(-c2ccc(F)cc2Cl)c(C)nn1C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.43
LCK P06239 2/20 0.42
TDP1 Q9NUW8 1/20 0.39
SRC P12931 1/20 0.38
CHRNA7 P36544 1/20 0.36
SLC34A1 Q06495 3/20 0.36
IGF1R P08069 2/20 0.36
P2RX7 Q99572 3/20 0.35
MAPK14 Q16539 2/20 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
SCHEMBL168600 0.95 HSD11B1 (0.42) HSD11B1LCKTDP1SLC34A1IGF1R
SCHEMBL31414012 0.94 HSD11B1 (0.46) HSD11B1LCKTDP1SLC34A1IGF1R
SCHEMBL173315 0.92 HSD11B1 (0.40) HSD11B1LCKTDP1CHRNA7SLC34A1
SCHEMBL175809 0.92 LCK (0.41) HSD11B1LCKTDP1SRCCHRNA7
SCHEMBL29369400 0.91 HSD11B1 (0.43) HSD11B1LCKSLC34A1IGF1RP2RX7
SCHEMBL170786 0.91 HSD11B1 (0.43) HSD11B1LCKSLC34A1IGF1RP2RX7
SCHEMBL168636 0.90 LCK (0.40) HSD11B1LCKTDP1SRCCHRNA7
SCHEMBL170970 0.90 HSD11B1 (0.39) HSD11B1LCKTDP1SLC34A1IGF1R
SCHEMBL175783 0.88 HSD11B1 (0.42) HSD11B1SLC34A1IGF1RP2RX7
SCHEMBL29367611 0.88 HSD11B1 (0.42) HSD11B1SLC34A1IGF1RP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170150719-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES FMC CORPORATION 2017-06-01 US claimed
US-20150305339-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES FMC CORPORATION 2015-10-29 US claimed
EP-2611296-A2 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E.I. Du Pont De Nemours And Company (US) 2013-07-10 EP claimed
US-20130129839-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-23 US claimed
WO-2012031061-A2 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-03-08 WO claimed
US-20170150719-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES FMC CORPORATION 2017-06-01 US disclosed
US-9596853-B2 Fungicidal pyrazoles and their mixtures E I DU PONT DE NEMOURS AND COMPANY (US) 2017-03-21 US disclosed
US-20150305339-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES FMC CORPORATION 2015-10-29 US disclosed
US-9107412-B2 Fungicidal pyrazoles and their mixtures E I DU PONT DE NEMOURS AND COMPANY (US) 2015-08-18 US disclosed
EP-2611296-A2 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E.I. Du Pont De Nemours And Company (US) 2013-07-10 EP disclosed
US-20130129839-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-23 US disclosed
WO-2012031061-A2 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES 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 (3 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-20130129839-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES CYP1B1, NOX3, NOX1 HSD11B1 1540/4885LCK 2666/4885TDP1 1646/4885
US-20150305339-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES CYP1B1, NOX3, NOX1 HSD11B1 1540/4885LCK 2666/4885TDP1 1646/4885
US-20170150719-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES CYP1B1, NOX3, NOX1 HSD11B1 1540/4885LCK 2666/4885TDP1 1646/4885

“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.