SCHEMBL8933222

SCHEMBL8933222

CCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)c(F)c4F)cc3)c(F)c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.36
CYP2C9 P11712 3/20 0.36
RARB P10826 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
FASN P49327 1/20 0.35
APP P05067 2/20 0.34
CYP2C8 P10632 1/20 0.34
S1PR3 Q99500 1/20 0.34
RORC P51449 2/20 0.33
RORA P35398 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
SPHK1 Q9NYA1 5/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
DGAT1 O75907 1/20 0.32
SOAT1 P35610 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL8932944 0.99 CYP3A4 (0.36) CYP3A4CYP2C9RARBGAAMAPT
SCHEMBL8958797 0.96 CYP3A4 (0.35) CYP3A4CYP2C9RARBGAAMAPT
SCHEMBL8932757 0.91 CYP2C9 (0.40) CYP3A4CYP2C9MAPTFASNAPP
SCHEMBL4401705 0.91 CYP2C9 (0.39) CYP3A4CYP2C9GAAMAPTSPHK1
SCHEMBL22277193 0.90 CYP2C9 (0.38) CYP3A4CYP2C9GAAMAPTSPHK1
SCHEMBL10659185 0.90 CYP3A4 (0.43) CYP3A4CYP2C9RARBGAAMAPT
SCHEMBL10942292 0.89 CYP3A4 (0.38) CYP3A4CYP2C9RARBGAAMAPT
SCHEMBL10942297 0.89 CYP3A4 (0.38) CYP3A4CYP2C9RARBGAAMAPT
SCHEMBL8831427 0.89 CYP3A4 (0.44) CYP3A4CYP2C9RARBGAAMAPT
SCHEMBL4799678 0.89 CYP3A4 (0.44) CYP3A4CYP2C9RARBGAAMAPT

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-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

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 CYP3A4 1445/4885CYP2C9 2391/4885RARB 3042/4885

“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.