SCHEMBL3146828

SCHEMBL3146828

Cc1nc(C(F)F)c(C(=O)Nc2ccccc2C2CCCCC2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
HSD17B10 Q99714 1/20 0.42
RAB9A P51151 4/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 5/20 0.39
MEN1 O00255 3/20 0.39
NPC1 O15118 3/20 0.39
RIPK1 Q13546 1/20 0.39
RXFP1 Q9HBX9 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RCE1 Q9Y256 1/20 0.35
NPY1R P25929 1/20 0.35
NPY2R P49146 1/20 0.35
MAP4K1 Q92918 1/20 0.35
TP53 P04637 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
SCHEMBL13478938 1.00 CNR1 (0.43) CNR1CNR2HSD17B10RAB9ARECQL
SCHEMBL13980917 0.99 CNR1 (0.43) CNR1CNR2HSD17B10RAB9ARECQL
SCHEMBL13478948 0.89 CNR1 (0.40) CNR1CNR2HSD17B10RAB9ARECQL
SCHEMBL13478964 0.85 RAB9A (0.37) CNR1CNR2HSD17B10RAB9AKMT2A
SCHEMBL3147087 0.83 MAPT (0.46) CNR1CNR2HSD17B10RAB9ARECQL
SCHEMBL4815896 0.82 MAPT (0.47) CNR1CNR2HSD17B10RAB9ARECQL
SCHEMBL3143993 0.81 KMT2A (0.36) CNR1CNR2HSD17B10RAB9ARECQL
SCHEMBL12903702 0.81 HTT (0.51) HSD17B10RAB9ARECQLKMT2ANPC1
SCHEMBL2911307 0.79 RAB9A (0.46) RAB9ARECQLKMT2AMEN1NPC1
SCHEMBL4658459 0.79 KMT2A (0.36) CNR1CNR2RAB9ARECQLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558592-B1 THIAZOL-(BI)CYCLOALKYL-CARBOXANILIDES BAYER CROPSCIENCE AG (DE) 2010-02-17 EP disclosed
EP-1558592-B1 THIAZOL-(BI)CYCLOALKYL-CARBOXANILIDES BAYER CROPSCIENCE AG (DE) 2010-02-17 EP disclosed
US-7470793-B2 Thiazol-(bi)cycloalkyl-carboxanilides BAYER CROPSCIENCE AG (DE) 2008-12-30 US disclosed
US-7470793-B2 Thiazol-(bi)cycloalkyl-carboxanilides BAYER CROPSCIENCE AG (DE) 2008-12-30 US disclosed
US-7470793-B2 Thiazol-(bi)cycloalkyl-carboxanilides BAYER CROPSCIENCE AG (DE) 2008-12-30 US disclosed
US-20060155122-A1 Thiazol-(bi)cycloalkyl-carboxanilides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2006-07-13 US disclosed
EP-1558592-A1 THIAZOL-(BI)CYCLOALKYL-CARBOXANILIDES Bayer CropScience Aktiengesellschaft (DE) 2005-08-03 EP disclosed
WO-2004039789-A1 THIAZOL-(BI)CYCLOALKYL-CARBOXANILIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-05-13 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-20060155122-A1 Thiazol-(bi)cycloalkyl-carboxanilides MRPL21, Q6ZSR9, QPCT CNR1 624/4885CNR2 804/4885HSD17B10 1162/4885

“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.