SCHEMBL18735552

SCHEMBL18735552

Cc1ccc(-c2cc(F)c(-c3ccc(C(F)(F)Oc4cc(F)c(F)c(F)c4)cc3)c(F)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
NPBWR1 P48145 1/20 0.32
ANPEP P15144 1/20 0.31
PPARD Q03181 1/20 0.30
KIF11 P52732 1/20 0.30
PTPN5 P54829 1/20 0.30
RPS6KA3 P51812 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
SCHEMBL4432399 0.92 PTPN5 (0.34) CYP11B1CYP11B2NPBWR1PPARDPTPN5
SCHEMBL15603972 0.88 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL18735548 0.87 AKR1C3 (0.33) RPS6KA3
SCHEMBL2741545 0.87 TSHR (0.34) KIF11
SCHEMBL18735554 0.86 AURKA (0.37) PPARDKIF11
SCHEMBL18808080 0.86 TTR (0.34)
SCHEMBL16866174 0.85 AKR1C3 (0.37) KIF11PTPN5
SCHEMBL18719622 0.84 MAOB (0.34)
SCHEMBL18735549 0.84 PDE2A (0.34) PPARD
SCHEMBL20380670 0.83 PTGS2 (0.34) CYP11B1CYP11B2NPBWR1RPS6KA3

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 CYP11B1 3813/4885CYP11B2 4119/4885NPBWR1 2508/4885

“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.