SCHEMBL4492837

SCHEMBL4492837

FC(F)(F)Oc1cccc(-c2cc3ccc(Cl)cc3n3nnnc23)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CUL4A Q13619 1/20 0.42
HSD11B1 P28845 1/20 0.39
ACLY P53396 1/20 0.38
ADORA1 P30542 2/20 0.37
ADORA2A P29274 1/20 0.37
DYRK1A Q13627 4/20 0.36
P2RX1 P51575 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
P2RX7 Q99572 1/20 0.35
XDH P47989 1/20 0.35
RXRA P19793 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
PIM1 P11309 4/20 0.35
PIM2 Q9P1W9 2/20 0.35
FLT3 P36888 1/20 0.35
CLK2 P49760 1/20 0.34
HASPIN Q8TF76 1/20 0.34
MAPT P10636 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
SCHEMBL4487616 0.88 CUL4A (0.44) CUL4AHSD11B1ACLYRXFP1GRIN2B
SCHEMBL5427940 0.86 MAOB (0.46) CUL4AADORA1MAPT
SCHEMBL5438084 0.84 CUL4A (0.44) CUL4ADYRK1ARXFP1MAPT
SCHEMBL4493991 0.82 CUL4A (0.47) CUL4AADORA1RXFP1MAPT
SCHEMBL4508267 0.78 CUL4A (0.47) CUL4ARXFP1MAPT
SCHEMBL4498290 0.77 CUL4A (0.49) CUL4ARXFP1MAPT
SCHEMBL5108852 0.76 CUL4A (0.48) CUL4ARXFP1P2RX7MAPT
SCHEMBL5103400 0.74 CUL4A (0.51) CUL4ARXFP1FLT3MAPT
SCHEMBL4497479 0.74 CUL4A (0.46) CUL4AHSD11B1RXFP1MAPT
SCHEMBL4558931 0.70 PDE2A (0.49) CUL4ARXFP1MAPT

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
EP-1668009-A1 HCV INHIBITORS AND METHODS OF USING THEM Rigel Pharmaceuticals, Inc. (US) 2006-06-14 EP claimed
US-20050090521-A1 HCV inhibitors and methods of using them RIGEL PHARMACEUTICALS, INC. 2005-04-28 US claimed
WO-2005030774-A1 HCV INHIBITORS AND METHODS OF USING THEM RIGEL PHARMACEUTICALS, INC. (US) 2005-04-07 WO claimed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20050282850-A1 Heterotricylic compounds for use as HCV inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-12-22 US 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-20070149520-A1 HCV Inhibitors And Methods Of Using Them HAVCR2, GLS2, EIF2AK2 CUL4A 56/4885HSD11B1 3751/4885ACLY 576/4885
US-20050090521-A1 HCV inhibitors and methods of using them HAVCR2, GLS2, EIF2AK2 CUL4A 56/4885HSD11B1 3751/4885ACLY 576/4885
US-20050282850-A1 Heterotricylic compounds for use as HCV inhibitors HAVCR2, PYGL, HCCS CUL4A 99/4885HSD11B1 3016/4885ACLY 554/4885

“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.