SCHEMBL7735375

SCHEMBL7735375

C=CCC[C@H]1CC[C@H](c2ccc(C(F)(F)Oc3cc(F)c(F)c(F)c3)cc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.32
ESR2 Q92731 1/20 0.32
HTR2C P28335 1/20 0.30
DGAT1 O75907 1/20 0.30
SOAT1 P35610 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL7735377 1.00 CCR2 (0.32) CCR2ESR2HTR2CDGAT1SOAT1
SCHEMBL12028508 0.97 DGAT1 (0.34) CCR2ESR2DGAT1SOAT1
SCHEMBL7732612 0.93 CCR2 (0.33) CCR2ESR2
SCHEMBL7732608 0.93 CCR2 (0.33) CCR2ESR2
SCHEMBL8370018 0.91 CCR2 (0.34) CCR2ESR2
SCHEMBL8370017 0.91 CCR2 (0.34) CCR2ESR2
SCHEMBL7730880 0.88 GRM2 (0.30)
SCHEMBL7730885 0.88 GRM2 (0.30)
SCHEMBL8470877 0.87 CCR2 (0.33) CCR2ESR2ALDH1A1LMNAMAPT
SCHEMBL7732619 0.87 CCR2 (0.33) CCR2ESR2ALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed
US-5858270-A Difluorooxymethane derivative and liquid crystal composition CHISSO CORPORATION (JP) 1999-01-12 US disclosed
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed