SCHEMBL4183229

SCHEMBL4183229

CC(Oc1ccc2cc(-c3nn(C4CCCCO4)c4ccc(C#N)cc34)ccc2c1)C1CCC(=O)N1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CMKLR1 Q99788 2/20 0.36
SYK P43405 3/20 0.33
FLT3 P36888 2/20 0.33
AURKB Q96GD4 1/20 0.33
IRAK4 Q9NWZ3 4/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
RET P07949 1/20 0.31
PDE9A O76083 3/20 0.31
PFKFB3 Q16875 1/20 0.31
ATR Q13535 1/20 0.30
CREBBP Q92793 1/20 0.30
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 1/20 0.30

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
SCHEMBL4094452 0.90 CMKLR1 (0.37) CMKLR1SYKFLT3AURKBRXRA
SCHEMBL4089146 0.90 CMKLR1 (0.37) CMKLR1SYKFLT3AURKBRXRA
SCHEMBL4080214 0.86 SCN9A (0.35) CMKLR1SYKFLT3AURKBRXRA
SCHEMBL4088673 0.84 CMKLR1 (0.37) CMKLR1RXRARXRBRXRGPTGDR2
SCHEMBL4094652 0.83 RAB9A (0.37) CMKLR1RXRARXRBRXRGATR
SCHEMBL4079783 0.82 CMKLR1 (0.36) CMKLR1RXRARXRBRXRGATR
SCHEMBL5381479 0.81 CMKLR1 (0.34) CMKLR1SYKFLT3AURKBPTGDR2
SCHEMBL4089935 0.81 CMKLR1 (0.40) CMKLR1RXRARXRBRXRGPTGDR2
SCHEMBL4080029 0.80 CMKLR1 (0.35) CMKLR1RXRARXRBRXRGATR
SCHEMBL5378043 0.80 RXRA (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 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 (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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 CMKLR1 1073/4885SYK 375/4885FLT3 1140/4885

“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.