SCHEMBL1774175

SCHEMBL1774175

Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2nc(/C=C/c3ccccc3)cs2)CC1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
CCR1 P32246 2/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 3/20 0.42
TSHR P16473 1/20 0.42
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
SPR P35270 1/20 0.36
LMNA P02545 2/20 0.36
CXCR3 P49682 1/20 0.36
KCNH2 Q12809 1/20 0.36
FAAH O00519 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL1774177 1.00 GAA (0.44) GAACCR1KDM4EPOLBTSHR
SCHEMBL1773981 0.92 GAA (0.42) GAACCR1KDM4EPOLBTSHR
SCHEMBL1773982 0.92 GAA (0.42) GAACCR1KDM4EPOLBTSHR
SCHEMBL1774036 0.90 KDM4E (0.38) GAACCR1KDM4EPOLBTSHR
SCHEMBL1774034 0.90 KDM4E (0.38) GAACCR1KDM4EPOLBTSHR
SCHEMBL1773829 0.88 GAA (0.42) GAACCR1KDM4EPOLBTSHR
SCHEMBL1773828 0.88 GAA (0.42) GAACCR1KDM4EPOLBTSHR
SCHEMBL1774227 0.88 GAA (0.42) GAACCR1KDM4EPOLBTSHR
SCHEMBL1774040 0.87 GAA (0.49) GAACCR1KDM4EPOLBTSHR
SCHEMBL1773903 0.87 GAA (0.41) GAACCR1KDM4EPOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334669-B1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS BAYER IP GMBH (DE) 2015-12-23 EP disclosed
EP-2334669-A1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS Bayer CropScience AG (DE) 2011-06-22 EP disclosed
US-7943774-B2 Heterocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2011-05-17 US disclosed
US-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
WO-2010037479-A1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS BAYER CROPSCIENCE AG (DE) 2010-04-08 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 (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-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents CYP8B1, CYP51A1, HPD GAA 217/4885CCR1 2946/4885KDM4E 3603/4885

“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.