SCHEMBL4879256

SCHEMBL4879256

CCC(=O)Nc1cc(C)c(-c2ccc(OC(F)(F)F)cc2OC)nc1OC

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 6/20 0.54
ADORA3 P0DMS8 2/20 0.48
HTT P42858 1/20 0.40
CSNK1D P48730 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
AHR P35869 1/20 0.39
CTSA P10619 1/20 0.39
ABL1 P00519 1/20 0.38
GRM7 Q14831 1/20 0.38
SCN9A Q15858 1/20 0.38

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
SCHEMBL6356902 0.92 CRHR1 (0.52) CRHR1ADORA3CSNK1DALDH1A1GRM7
SCHEMBL4882797 0.83 CRHR1 (0.56) CRHR1ADORA3SCN9A
SCHEMBL6347606 0.82 CRHR1 (0.54) CRHR1ADORA3HSD17B10MAPK1CTSA
SCHEMBL6343532 0.82 CRHR1 (0.55) CRHR1SCN9A
SCHEMBL4881314 0.77 CRHR1 (0.49) CRHR1ADORA3HSD17B10MAPK1CTSA
SCHEMBL4878756 0.77 CRHR1 (0.55) CRHR1ADORA3HTTSMN1; SMN2ALDH1A1
SCHEMBL14183041 0.76 CRHR1 (0.56) CRHR1ADORA3SCN9A
SCHEMBL4882896 0.76 CRHR1 (0.60) CRHR1SCN9A
SCHEMBL4881389 0.75 CRHR1 (0.54) CRHR1
SCHEMBL6602770 0.75 CRHR1 (0.54) CRHR1CTSAGRM7SCN9A

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
US-20080107608-A1 5-Substituted-2-Arylpyridines GE PING 2008-05-08 US disclosed
US-20080107608-A1 5-Substituted-2-Arylpyridines GE PING 2008-05-08 US disclosed
US-20080107608-A1 5-Substituted-2-Arylpyridines GE PING 2008-05-08 US disclosed
US-7223778-B2 5-substituted-2-arylpyridines NEUROGEN CORPORATION (US) 2007-05-29 US disclosed
US-7223778-B2 5-substituted-2-arylpyridines NEUROGEN CORPORATION (US) 2007-05-29 US disclosed
EP-1392302-A1 5-SUBSTITUTED-2-ARYLPYRIDINES AS CRF1 MODULATORS NEUROGEN CORPORATION (US) 2004-03-03 EP disclosed
US-20030152520-A1 5-Substituted-2-arylpyridines NEUROGEN CORPORATION 2003-08-14 US disclosed
WO-2002096421-A1 5-SUBSTITUTED-2-ARYLPYRIDINES AS CRF1 MODULATORS NEUROGEN CORPORATION (US) 2002-12-05 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-20030152520-A1 5-Substituted-2-arylpyridines HTR5A, CRHR2, HTR2C CRHR1 5/4885ADORA3 229/4885HTT 631/4885
US-20080107608-A1 5-Substituted-2-Arylpyridines CRHR2, CRHR1, HTR2C CRHR1 2/4885ADORA3 306/4885HTT 957/4885

“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.