SCHEMBL5478642

SCHEMBL5478642

CC(C)(C)c1ccc(-c2ccc(S)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.56
TSHR P16473 1/20 0.48
LMNA P02545 2/20 0.46
TYR P14679 1/20 0.46
XDH P47989 1/20 0.44
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
KDM4E B2RXH2 3/20 0.39
HTR1D P28221 1/20 0.39
ADRA1A P35348 1/20 0.39
NISCH Q9Y2I1 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TP53 P04637 2/20 0.38
KMT2A Q03164 2/20 0.38
MITF O75030 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DGAT1 O75907 1/20 0.37
NOTUM Q6P988 1/20 0.37
SCN5A Q14524 1/20 0.37

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
SCHEMBL14707718 1.00 KIF11 (0.56) KIF11TSHRLMNATYRXDH
SCHEMBL67741 0.92 TSHR (0.55) KIF11TSHRLMNATYRNPC1
Iodide SCHEMBL217484 0.89 TSHR (0.52) KIF11TSHRLMNATYRNPC1
SCHEMBL6516058 0.89 TSHR (0.52) KIF11TSHRLMNATYRNPC1
SCHEMBL6524730 0.89 TSHR (0.52) KIF11TSHRLMNATYRNPC1
SCHEMBL18017084 0.87 KIF11 (0.50) KIF11TSHRLMNATYRXDH
SCHEMBL17428518 0.87 KIF11 (0.50) KIF11TSHRLMNATYRXDH
SCHEMBL26915 0.86 KIF11 (0.70) KIF11TSHRLMNATYRXDH
SCHEMBL3423876 0.86 KIF11 (0.70) KIF11TSHRLMNATYRXDH
SCHEMBL16787954 0.84 TSHR (0.48) KIF11TSHRLMNATYRNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230301182-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-09-21 US disclosed
CN-116710846-A Photosensitive resin composition, photosensitive resin coating film, photosensitive dry film, and pattern forming method 信越化学工业株式会社 2023-09-05 CN disclosed
US-7270857-B2 Liquid crystal composition and liquid crystal element FUJIFILM CORPORATION (JP) 2007-09-18 US disclosed
US-7270857-B2 Liquid crystal composition and liquid crystal element FUJIFILM CORPORATION (JP) 2007-09-18 US disclosed
US-7270857-B2 Liquid crystal composition and liquid crystal element FUJIFILM CORPORATION (JP) 2007-09-18 US disclosed
US-7220465-B2 Liquid crystal composition, anthraquinone compound and liquid crystal device employing the composition FUJIFILM CORPORATION (JP) 2007-05-22 US disclosed
US-7220465-B2 Liquid crystal composition, anthraquinone compound and liquid crystal device employing the composition FUJIFILM CORPORATION (JP) 2007-05-22 US disclosed
US-7220465-B2 Liquid crystal composition, anthraquinone compound and liquid crystal device employing the composition FUJIFILM CORPORATION (JP) 2007-05-22 US disclosed
US-20050173673-A1 Liquid crystal composition, anthraquinone compound and liquid crystal device employing the composition FUJI PHOTO FILM CO., LTD. (JP) 2005-08-11 US disclosed
US-20050072962-A1 Liquid crystal composition and liquid crystal element FUJI PHOTO FILM CO., LTD. (JP) 2005-04-07 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 (2 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-20230301182-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME OR10J3, ESR1, EPCAM KIF11 2629/4885TSHR 4575/4885LMNA 3840/4885
US-20050072962-A1 Liquid crystal composition and liquid crystal element CXCR1, CXCR2, LRRK2 KIF11 1916/4885TSHR 2047/4885LMNA 1983/4885

“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.