SCHEMBL12223357

SCHEMBL12223357

CCOc1ccc(C2CCC(c3ccc(OC(=O)C4CCC(c5ccc(C(C)O)c(F)c5F)CC4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.41
▸ GLA P06280 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ACACB O00763 3/20 0.33
▸ MAPT P10636 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ SSTR5 P35346 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ PPARD Q03181 1/20 0.31
▸ CYP3A4 P08684 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
SCHEMBL11939333 0.96 HPGD (0.39) HPGDGLALMNAALOX15SMN1; SMN2
SCHEMBL11939267 0.96 HPGD (0.39) HPGDGLALMNAALOX15SMN1; SMN2
SCHEMBL12223508 0.93 HPGD (0.37) HPGDGLALMNAALOX15SMN1; SMN2
SCHEMBL14922676 0.91 HPGD (0.47) HPGDGLALMNAALOX15SMN1; SMN2
SCHEMBL12222988 0.90 HPGD (0.40) HPGDGLALMNAALOX15SMN1; SMN2
SCHEMBL12823680 0.89 HPGD (0.41) HPGDGLALMNAALOX15SMN1; SMN2
SCHEMBL13586146 0.89 HPGD (0.41) HPGDGLALMNAALOX15SMN1; SMN2
SCHEMBL12223403 0.89 TP53 (0.34) LMNAALOX15SMN1; SMN2MEN1KMT2A
SCHEMBL10303398 0.89 TP53 (0.34) LMNAALOX15SMN1; SMN2MEN1KMT2A
SCHEMBL12224194 0.89 HPGD (0.39) HPGDGLALMNAALOX15SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-10-06 — — 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-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE NCAPD3, CCND3, ZKSCAN2 HPGD 4261/4885GLA 3232/4885LMNA 1171/4885

“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.

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