SCHEMBL4084834

SCHEMBL4084834

CCNC(=O)c1ccc2cc(-c3nn(C4CCCCO4)c4ccc(C#N)cc34)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 8/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
DGAT2 Q96PD7 2/20 0.38
CD274 Q9NZQ7 1/20 0.38
FASN P49327 1/20 0.37
NAMPT P43490 3/20 0.37
EGFR P00533 1/20 0.37
BTK Q06187 1/20 0.37
ADORA2A P29274 1/20 0.36
CNR2 P34972 1/20 0.36
ATM Q13315 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
SCHEMBL4084335 0.88 RXRA (0.42) RXRARXRBRXRGL3MBTL1
SCHEMBL4089930 0.87 RXRA (0.38) EGLN1RXRARXRBRXRG
SCHEMBL4084768 0.87 JAK2 (0.40) EGLN1RXRARXRBRXRGDGAT2
SCHEMBL4088986 0.85 RXRA (0.40) RXRARXRBRXRGDGAT2CD274
SCHEMBL4090008 0.85 CDK1 (0.39) RXRARXRBRXRGFASNNAMPT
SCHEMBL4080192 0.83 RXRA (0.39) RXRARXRBRXRG
SCHEMBL5378043 0.83 RXRA (0.38) RXRARXRBRXRGDGAT2ADORA2A
SCHEMBL5786180 0.82 RXRA (0.38) RXRARXRBRXRGDGAT2CD274
SCHEMBL4094652 0.81 RAB9A (0.37) RXRARXRBRXRG
SCHEMBL4083268 0.81 RXRA (0.37) RXRARXRBRXRGDGAT2

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-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 EGLN1 2553/4885RXRA 2265/4885RXRB 2226/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 EGLN1 2458/4885RXRA 2170/4885RXRB 2113/4885

“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.