SCHEMBL817841

SCHEMBL817841

CO[C](C)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
CES1 P23141 4/20 0.44
CES2 O00748 3/20 0.44
SRC P12931 1/20 0.43
LMNA P02545 3/20 0.42
POLB P06746 2/20 0.42
MAPK1 P28482 2/20 0.41
HTT P42858 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ELANE P08246 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
F2 P00734 1/20 0.40

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
SCHEMBL9311224 0.76 TSHR (0.52) TSHRCES1CES2SRCLMNA
SCHEMBL15988227 0.74 TSHR (0.56) TSHRCES1CES2SRCLMNA
SCHEMBL1193711 0.74 TSHR (0.56) TSHRCES1CES2SRCLMNA
SCHEMBL10873087 0.74 TSHR (0.56) TSHRCES1CES2SRCLMNA
SCHEMBL93631 0.74 TSHR (0.56) TSHRCES1CES2SRCLMNA
SCHEMBL4019330 0.74 TSHR (0.56) TSHRCES1CES2SRCLMNA
SCHEMBL1603720 0.74 TSHR (0.56) TSHRCES1CES2SRCLMNA
SCHEMBL25137264 0.74 TSHR (0.50) TSHRCES1CES2SRCLMNA
SCHEMBL17895051 0.74 MAPT (0.47) CES1CES2LMNAMAPK1L3MBTL1
SCHEMBL5080161 0.74 TSHR (0.50) TSHRCES1CES2SRCLMNA

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 149 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3089980-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2018-01-31 EP claimed
US-9670208-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2017-06-06 US claimed
EP-3089980-A1 SERINE/THREONINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2016-11-09 EP claimed
US-20160304519-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2016-10-20 US claimed
WO-2015103137-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2015-07-09 WO claimed
CN-101189246-B Process for the production of isocyanatosilane and silylisocyanurate MOMENTIVE PERFORMANCE MAT INC 2012-08-08 CN claimed
CN-101759883-A Rubber composition KOREA TYRE CO LTD 2010-06-30 CN claimed
CN-101268087-A Method for production of isocyanatosilanes MOMENTIVE PERFORMANCE MAT INC (US) 2008-09-17 CN claimed
CN-101189246-A Process for the production of isocyanatosilane and silylisocyanurate MOMENTIVE PERFORMANCE MAT INC (US) 2008-05-28 CN claimed
US-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US claimed
CN-1965377-A Anti-corrosion additive for electrical cable restoration fluids DOW CORNING (US) 2007-05-16 CN claimed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP claimed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US claimed
US-4479966-A 6,9-Methano-PGI2 analogues ONO PHARMACEUTICAL COMPANY, LTD. (JP) 1984-10-30 US claimed
EP-0073566-A1 Methods and compositions for combating soil pests IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-03-09 EP claimed
US-11376260-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2022-07-05 US disclosed
US-20210106593-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2021-04-15 US disclosed
US-4390548-A Trans-Δ2 -pge alkylsulphonyl amides ONO PHARMACEUTICAL CO., LTD. (JP) 1983-06-28 US disclosed
US-4367237-A THIOPGI-1 DERIVATIVES; OXYTOCICS; PREFERENTIAL ONO PHARMACEUTICAL CO., LTD. (JP) 1983-01-04 US disclosed
US-4351846-A 3-Hydroxy and 3-oxo-prostaglandin analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1982-09-28 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 (4 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-11376260-B2 Serine/threonine kinase inhibitors MAP3K1, MAP3K4, MAP4K2 TSHR 2044/4885CES1 2991/4885CES2 4564/4885
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 TSHR 4680/4885CES1 4486/4885CES2 4281/4885
US-20160304519-A1 SERINE/THREONINE KINASE INHIBITORS TTBK1, MAP3K1, TNNI3K TSHR 2352/4885CES1 2173/4885CES2 4081/4885
US-20210106593-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 TSHR 2044/4885CES1 2991/4885CES2 4564/4885

“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.