SCHEMBL6002555

SCHEMBL6002555

CCCCOS(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
LTA4H P09960 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 4/20 0.41
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 2/20 0.41
CYP24A1 Q07973 1/20 0.41
CCNE2 O96020 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.40
LMNA P02545 2/20 0.40
EPHX2 P34913 1/20 0.40
PKM P14618 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL6002444 0.94 TSHR (0.47) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL8915435 0.93 TSHR (0.49) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL20526214 0.93 TSHR (0.49) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL27521423 0.93 TSHR (0.49) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL29575676 0.91 TSHR (0.47) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL30528958 0.91 TSHR (0.47) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL11286528 0.88 LMNA (0.46) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL28316278 0.86 LMNA (0.44) TSHRTDP1L3MBTL1LTA4HSMN1; SMN2
SCHEMBL6744587 0.83 RECQL (0.47) TSHRTDP1L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL1846993 0.81 CYP24A1 (0.41) TDP1L3MBTL1CYP24A1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10930872-B2 Light-emitting electrochemical cell, composition for forming light-emitting layer of light-emitting electrochemical cell, and ionic compound for light-emitting layer of light-emitting electrochemical cell NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2021-02-23 US disclosed
US-20180301653-A1 LIGHT-EMITTING ELECTROCHEMICAL CELL, COMPOSITION FOR FORMING LIGHT-EMITTING LAYER OF LIGHT-EMITTING ELECTROCHEMICAL CELL, AND IONIC COMPOUND FOR LIGHT-EMITTING LAYER OF LIGHT-EMITTING ELECTROCHEMICAL CELL NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2018-10-18 US disclosed
EP-3386274-A1 ELECTROCHEMICAL LIGHT EMITTING CELL, COMPOSITION FOR FORMING LIGHT EMITTING LAYER OF ELECTROCHEMICAL LIGHT EMITTING CELL, AND IONIC COMPOUND FOR LIGHT EMITTING LAYER OF ELECTROCHEMICAL LIGHT EMITTING CELL Nippon Chemical Industrial Co., Ltd. (JP) 2018-10-10 EP disclosed
CN-108293284-A The luminescent layer ionic compound of electrochemical luminescence unit, the luminescent layer formation composition of electrochemical luminescence unit and electrochemical luminescence unit 日本化学工业株式会社 2018-07-17 CN disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO 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-10930872-B2 Light-emitting electrochemical cell, composition for forming light-emitting layer of light-emitting electrochemical cell, and ionic compound for light-emitting layer of light-emitting electrochemical cell CRY2, CRY1, L1CAM TSHR 2939/4885TDP1 2826/4885L3MBTL1 1990/4885

“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.