SCHEMBL8965488

SCHEMBL8965488

C=CC(=O)OCCC(O)COC(=O)C=C

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
ALDH1A1 P00352 5/20 0.52
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
CYP3A4 P08684 3/20 0.52
HSD17B10 Q99714 1/20 0.52
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.42
MAPK1 P28482 1/20 0.42
THRB P10828 2/20 0.40
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL6368712 0.90 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL12698769 0.89 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9542151 0.89 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL1405778 0.89 TSHR (0.59) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL30733262 0.88 HCAR2 (0.46) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL11920348 0.88 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23011336 0.87 TSHR (0.53) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28412959 0.87 TSHR (0.62) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL95157 0.85 TSHR (0.64) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27542565 0.85 TSHR (0.47) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101472966-A Michael addition products as additives for paper and papermaking HERCULES INC (US) 2009-07-01 CN claimed
CN-101463193-A Dye composition for lens PRODISC TECHNOLOGY INC (CN) 2009-06-24 CN claimed
CN-110121515-B Fluorine-containing active energy ray-curable resin, surfactant, active energy ray-curable resin composition, and cured coating film DIC株式会社 2022-03-11 CN disclosed
CN-114089603-A Flexographic plate support body and preparation method and using method thereof 乐凯华光印刷科技有限公司 2022-02-25 CN disclosed
CN-102105504-A Method for producing radiation-curable prepolymers containing urethane groups BAYER TECHNOLOGY SERVICES GMBH 2011-06-22 CN disclosed
CN-102083925-A Binder for antifouling coating composition and antifouling coating composition comprising binder JOTUN AS 2011-06-01 CN disclosed
CN-101472966-B Michael addition products as additives for paper and papermaking HERCULES INC 2011-03-30 CN disclosed
CN-1637037-B Hardening agent BAYER MATERIALSCIENCE AG 2010-06-16 CN disclosed
CN-101730713-A Branched polymer and antifouling coating composition comprising the polymer JOTUN AS 2010-06-09 CN disclosed
CN-100506873-C Radiation cured polyurethanes with capped amino groups BASF AG (DE) 2009-07-01 CN disclosed
CN-101472966-A Michael addition products as additives for paper and papermaking HERCULES INC (US) 2009-07-01 CN disclosed
CN-101463193-A Dye composition for lens PRODISC TECHNOLOGY INC (CN) 2009-06-24 CN disclosed
CN-1694912-A Radiation cured polyurethanes with capped amino groups BASF AG (DE) 2005-11-09 CN disclosed
CN-1671486-A Radiation-curable coating system with low-temperature elastic base coat BASF AG (DE) 2005-09-21 CN disclosed
CN-1637037-A Hardening agent BAYER MATERIALSCIENCE LLC (DE) 2005-07-13 CN disclosed
US-5547762-A THERMOSETTING RESIN LAYER BRIDGESTONE CORPORATION (JP) 1996-08-20 US disclosed