SCHEMBL18735554

SCHEMBL18735554

Cc1ccc(-c2cc(F)c(-c3ccc(C(F)(F)Oc4ccc(OC(F)(F)F)cc4)cc3)c(F)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.37
TPX2 Q9ULW0 1/20 0.37
GPR3 P46089 1/20 0.37
KIF11 P52732 1/20 0.37
MMP12 P39900 1/20 0.36
CNR1 P21554 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PPARD Q03181 1/20 0.35
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
PRMT6 Q96LA8 1/20 0.34
DHODH Q02127 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
SCN5A Q14524 2/20 0.34
NISCH Q9Y2I1 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL18735549 0.89 PDE2A (0.34) GPR3TRPV1KDM4EPPARDSCN10A
SCHEMBL18735550 0.87 GPR3 (0.42) GPR3CNR1TRPV1AKR1C2PTGDR2
SCHEMBL18735552 0.86 CYP11B1 (0.32) KIF11PPARD
SCHEMBL15745093 0.83 PPARD (0.32) AURKATPX2GPR3KIF11MMP12
SCHEMBL10018707 0.82 ACHE (0.38) KIF11PPARDBCHEACHE
SCHEMBL7729109 0.82 ACHE (0.45) GPR3KIF11TRPV1KDM4EBCHE
SCHEMBL12152581 0.82 ACHE (0.38) KIF11PPARDBCHEACHE
SCHEMBL19415114 0.81 FFAR4 (0.44) GPR3KIF11SCN10ASCN5ANISCH
SCHEMBL12889548 0.79 FFAR4 (0.39) GPR3KIF11BCHEACHESCN10A
SCHEMBL4431222 0.79 NFE2L2 (0.38) GPR3TRPV1KDM4EPPARDFFAR4

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-9803140-B2 Liquid crystal compound and liquid crystal composition SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2017-10-31 US disclosed
US-20170101581-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2017-04-13 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-20170101581-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION LBR, CTNND1, CCNT1 AURKA 1616/4885TPX2 3202/4885GPR3 3536/4885

“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.