Sugi Predict

Sugi Predict / Compounds / SCHEMBL18177598

SCHEMBL18177598

SCHEMBL18177598

COc1cc([Si](C)(C)C)c(F)cc1-c1cc(F)c([Si](C)(C)C)cc1C=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ ERN1 O75460 13/20 0.38
▸ PRKDC P78527 2/20 0.37
▸ CYP3A4 P08684 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ GAA P10253 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL18181698 0.87 ERN1 (0.34) ERN1
SCHEMBL18177610 0.75 PRKDC (0.42) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL30865007 0.67 ALDH1A1 (0.75) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL4813783 0.67 ALDH1A1 (0.68) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL29950688 0.67 ALDH1A1 (0.68) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL8743252 0.66 ERN1 (0.37) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL436131 0.65 ALDH1A1 (0.54) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL71268 0.65 ALDH1A1 (0.65) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL29636410 0.65 ALDH1A1 (0.65) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL18177606 0.65 ERN1 (0.62) ALDH1A1KDM4ETSHRTDP1ERN1

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-9705095-B2 Organic transistor, compound, organic semiconductor material for non-light-emitting organic semiconductor device, material for organic transistor, coating solution for non-light-emitting organic semiconductor device, and organic semiconductor film for non-light-emitting organic semiconductor device FUJIFILM CORPORATION (JP) 2017-07-11 — — US disclosed
US-20160315271-A1 ORGANIC TRANSISTOR, COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, MATERIAL FOR ORGANIC TRANSISTOR, COATING SOLUTION FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, AND ORGANIC SEMICONDUCTOR FILM FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE FUJIFILM CORPORATION (JP) 2016-10-27 — — 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-20160315271-A1 ORGANIC TRANSISTOR, COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, MATERIAL FOR ORGANIC TRANSISTOR, COATING SOLUTION FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, AND ORGANIC SEMICONDUCTOR FILM FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE OR10J3, APOL1, OXSR1 ALDH1A1 3542/4885KDM4E 2655/4885TSHR 161/4885

“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.