SCHEMBL4088673

SCHEMBL4088673

N#Cc1ccc2c(c1)c(-c1ccc3cc(OC(F)F)ccc3c1)nn2C1CCCCO1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMKLR1 Q99788 2/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
ATR Q13535 3/20 0.35
KIT P10721 2/20 0.35
TDP2 O95551 1/20 0.35
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
MAT2A P31153 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
ABL1 P00519 2/20 0.32
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 2/20 0.31
CYP4F2 P78329 2/20 0.31
CYP4A11 Q02928 2/20 0.31
KMT2A Q03164 1/20 0.31
HTR3A P46098 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL4094652 0.89 RAB9A (0.37) CMKLR1RXRARXRBRXRGATR
SCHEMBL4079783 0.87 CMKLR1 (0.36) CMKLR1RXRARXRBRXRGATR
SCHEMBL4080434 0.87 RXRA (0.37) CMKLR1RXRARXRBRXRGATR
SCHEMBL5378043 0.86 RXRA (0.38) CMKLR1RXRARXRBRXRGATR
SCHEMBL4094452 0.86 CMKLR1 (0.37) CMKLR1RXRARXRBRXRGATR
SCHEMBL4089146 0.86 CMKLR1 (0.37) CMKLR1RXRARXRBRXRGATR
SCHEMBL4084335 0.85 RXRA (0.42) CMKLR1RXRARXRBRXRGATR
SCHEMBL4083268 0.85 RXRA (0.37) CMKLR1RXRARXRBRXRGATR
SCHEMBL4080192 0.85 RXRA (0.39) CMKLR1RXRARXRBRXRGATR
SCHEMBL4082983 0.85 SLC6A2 (0.38) CMKLR1RXRARXRBRXRGATR

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 CMKLR1 1073/4885RXRA 2265/4885RXRB 2226/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 CMKLR1 1136/4885RXRA 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.