SCHEMBL8932667

SCHEMBL8932667

C=CC1CCC(c2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.39
FASN P49327 1/20 0.35
FPR2 P25090 3/20 0.35
CYP3A4 P08684 3/20 0.34
CYP2C9 P11712 2/20 0.34
APP P05067 2/20 0.34
NAAA Q02083 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
GABRA1 P14867 3/20 0.32
GABRB2 P47870 3/20 0.32
FGFR2 P21802 2/20 0.32
FGFR1 P11362 1/20 0.32
DHODH Q02127 1/20 0.32
PDE4A P27815 2/20 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
SCHEMBL8959257 0.97 KDM1A (0.37) KDM1AFASNFPR2CYP3A4CYP2C9
SCHEMBL8933538 0.93 GABRA1 (0.40) KDM1AFASNFPR2CYP3A4CYP2C9
SCHEMBL15681400 0.92 KDM1A (0.35) KDM1AFPR2CYP3A4CYP2C9APP
SCHEMBL8933299 0.92 CNR2 (0.37) KDM1AFASNFPR2CYP3A4CYP2C9
SCHEMBL8933399 0.91 HTR2C (0.35) FASNCYP3A4CYP2C9APPCYP2D6
SCHEMBL22269483 0.91 KDM1A (0.34) KDM1AFPR2GABRA1GABRB2FGFR2
SCHEMBL8933308 0.91 GABRA1 (0.37) KDM1AFASNFPR2CYP3A4CYP2C9
SCHEMBL20803712 0.90 KDM1A (0.44) KDM1AFASNFPR2CYP3A4CYP2C9
SCHEMBL20803664 0.90 KDM1A (0.45) KDM1AFASNFPR2CYP3A4CYP2C9
SCHEMBL20803673 0.90 KDM1A (0.45) KDM1AFASNFPR2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 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-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, HCN3, FZD7 KDM1A 2117/4885FASN 2049/4885FPR2 1427/4885

“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.