SCHEMBL12366343

SCHEMBL12366343

Cc1cccc(OCC2CCC(CCC=O)CC2)c1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.41
BRD4 O60885 1/20 0.38
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
PDE10A Q9Y233 1/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2B Q13224 2/20 0.35
C5AR1 P21730 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
HPGD P15428 1/20 0.34
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
KCNN4 O15554 1/20 0.33
PDE4B Q07343 2/20 0.33
KAT6A Q92794 1/20 0.33

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
SCHEMBL12366346 0.87 RIPK1 (0.41) RIPK1BRD4ALDH1A1GLAPDE10A
SCHEMBL2270254 0.87 RIPK1 (0.40) RIPK1FFAR4HTR2AHTR2CHTR2B
SCHEMBL2270247 0.87 RIPK1 (0.40) RIPK1FFAR4HTR2AHTR2CHTR2B
SCHEMBL24153922 0.86 RIPK1 (0.47) RIPK1BRD4ALDH1A1GLAPDE10A
SCHEMBL12366340 0.85 BRD4 (0.42) RIPK1BRD4ALDH1A1GLAPDE10A
SCHEMBL20083011 0.79 MCHR1 (0.48) RIPK1BRD4ALDH1A1GLAHPGD
SCHEMBL12366336 0.79 BRD4 (0.40) RIPK1BRD4ALDH1A1GLAPDE10A
SCHEMBL12366291 0.76 RIPK1 (0.37) RIPK1BRD4ALDH1A1GLAPDE10A
SCHEMBL12366348 0.75 RIPK1 (0.36) RIPK1PDE10AHPGDHTR2AHTR2C
SCHEMBL13417684 0.74 RIPK1 (0.35) RIPK1PDE10AFFAR4HPGDHTR2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003006-B2 Difluorobenzene derivative and nematic liquid crystal composition using the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2011-08-23 US disclosed
US-20090200514-A1 DIFLUOROBENZENE DERIVATIVE AND NEMATIC LIQUID CRYSTAL COMPOSITION USING THE SAME DAINIPPON INK AND CHEMICALS, INC. (JP) 2009-08-13 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-20090200514-A1 DIFLUOROBENZENE DERIVATIVE AND NEMATIC LIQUID CRYSTAL COMPOSITION USING THE SAME TRPV2, HCN2, DVL1 RIPK1 2530/4885BRD4 1771/4885ALDH1A1 4012/4885

“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.