SCHEMBL289283

SCHEMBL289283

CCCCOCCOC(C)CC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
CYP3A4 P08684 2/20 0.43
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
EPHX2 P34913 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
USP2 O75604 1/20 0.31
RARB P10826 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
SCHEMBL4834938 1.00 TSHR (0.44) TSHRCYP3A4MAPTMEN1THRB
SCHEMBL4839751 0.93 HTT (0.48) TSHRCYP3A4MAPTMEN1THRB
SCHEMBL27905294 0.93 HTT (0.48) TSHRCYP3A4MAPTMEN1THRB
SCHEMBL28774505 0.91 HTT (0.52) TSHRCYP3A4MAPTMEN1THRB
SCHEMBL1476547 0.88 TDP1 (0.33) TDP1
SCHEMBL1476765 0.88 TDP1 (0.33) TDP1
SCHEMBL13380879 0.86 TDP1 (0.43) HSD17B10TDP1
SCHEMBL4830601 0.86 TDP1 (0.43) HSD17B10TDP1
SCHEMBL2759867 0.85
SCHEMBL25970008 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106928416-B Monovinylarene-conjugated diene copolymer, preparation method thereof, random linear copolymer, composition, vulcanized rubber and application 中国石油化工股份有限公司 2020-06-09 CN disclosed
US-10023760-B2 Semicarbazide composition, method for producing semicarbazide composition, aqueous polymer composition and composite ASAHI KASEI CHEMICALS CORPORATION (JP) 2018-07-17 US disclosed
US-20150291831-A1 SEMICARBAZIDE COMPOSITION, METHOD FOR PRODUCING SEMICARBAZIDE COMPOSITION, AQUEOUS POLYMER COMPOSITION AND COMPOSITE ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-10-15 US disclosed
EP-2921474-A1 SEMICARBAZIDE COMPOSITION, METHOD FOR PRODUCING SEMICARBAZIDE COMPOSITION, AQUEOUS RESIN COMPOSITION AND COMPOSITE Asahi Kasei Chemicals Corporation (JP) 2015-09-23 EP disclosed
CN-102898149-A Solvent or solvent composition for manufacturing laminated ceramic member DAICEL CHEM 2013-01-30 CN disclosed
CN-102731112-A Solvent or solvent composition for producing laminated ceramic component DAICEL FINECHEM LTD 2012-10-17 CN disclosed
EP-2427429-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS Abbott GmbH & Co. KG (DE) 2012-03-14 EP disclosed
WO-2010128102-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS ABBOTT GMBH & CO. KG (DE) 2010-11-11 WO disclosed
CN-101838389-A Epoxy modified water-based alkyd resin and preparation method thereof Wuhan linuo chemical group co ltd 2010-09-22 CN disclosed
EP-1429609-A1 HERBICIDAL MIXTURES BASED ON 3-PHENYLURACILS BASF AKTIENGESELLSCHAFT (DE) 2004-06-23 EP disclosed
EP-1416798-A2 THIAZOLO 4,5-b]PYRIDINES AS FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2004-05-12 EP disclosed
EP-1358164-A1 METHOD OF PRODUCING 1-ALKYL-3-ARYL-5-DIFLUOROMETHOXY-1H-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 2003-11-05 EP disclosed
WO-2003024221-A1 HERBICIDAL MIXTURES BASED ON 3-PHENYLURACILS BASF AKTIENGESELLSCHAFT (DE) 2003-03-27 WO disclosed
WO-2003006470-A2 THIAZOLO [4,5-b]PYRIDINES AS FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2003-01-23 WO disclosed
WO-2002055504-A1 METHOD OF PRODUCING 1-ALKYL-3-ARYL-5-DIFLUOROMETHOXY-1H-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 2002-07-18 WO disclosed
EP-1177179-A1 BENZOHETERO CYCLYLCYCLO HEXENONES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-02-06 EP disclosed
WO-2001092236-A1 4-ALKYL HALIDE TRIAZINE COMPOUNDS USED AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-12-06 WO disclosed
WO-2000068210-A1 BENZOHETERO CYCLYLCYCLO HEXENONES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-11-16 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 (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-20150291831-A1 SEMICARBAZIDE COMPOSITION, METHOD FOR PRODUCING SEMICARBAZIDE COMPOSITION, AQUEOUS POLYMER COMPOSITION AND COMPOSITE C9, C5, BRD2 TSHR 3717/4885CYP3A4 1663/4885MAPT 1905/4885
US-10023760-B2 Semicarbazide composition, method for producing semicarbazide composition, aqueous polymer composition and composite C9, C5, BRD2 TSHR 3717/4885CYP3A4 1663/4885MAPT 1905/4885

“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.