SCHEMBL1898937

SCHEMBL1898937

CC(C)(C)C(=O)CC(=O)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.50
CES2 O00748 1/20 0.48
AKR1B1 P15121 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
VNN1 O95497 1/20 0.46
POLB P06746 1/20 0.45
HSD11B1 P28845 1/20 0.44
CTBP2 P56545 1/20 0.44
EPHX2 P34913 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 1/20 0.42
RIPK1 Q13546 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL9318318 0.85 MAPT (0.43) CES1MEN1KMT2ATDP1L3MBTL1
SCHEMBL855690 0.84 CES1 (0.63) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL51367 0.81 CES1 (0.64) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL4753311 0.81 CES1 (0.71) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL6363616 0.79 CES1 (0.61) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL9111034 0.79 CES1 (0.61) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL1535041 0.78 CES1 (0.54) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL5217028 0.78 CES1 (0.54) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL6563606 0.78 CES1 (0.60) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL3966085 0.77 AKR1B1 (0.65) CES1CES2AKR1B1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250145823-A1 FOAM-FORMING COMPOSITIONS CONTAINING A METAL CARBOXYLATE CATALYST, RELATED FOAMS AND METHODS FOR THEIR PRODUCTION COVESTRO LLC 2025-05-08 US claimed
EP-4007783-A1 PULTRUSION PROCESSES FOR PRODUCING FIBER REINFORCED POLYURETHANE COMPOSITIONS AND POLYURETHANE-FORMING REACTION MIXTURES SUITABLE FOR USE IN SUCH PROCESSES Covestro LLC (US) 2022-06-08 EP claimed
CN-114206972-A Pultrusion process for preparing fiber reinforced polyurethane composites and polyurethane forming reaction mixtures suitable for use in such process 科思创有限公司 2022-03-18 CN claimed
WO-2021021505-A1 PULTRUSION PROCESSES FOR PRODUCING FIBER REINFORCED POLYURETHANE COMPOSITIONS AND POLYURETHANE-FORMING REACTION MIXTURES SUITABLE FOR USE IN SUCH PROCESSES COVESTRO LLC (US) 2021-02-04 WO claimed
US-4321304-A Beta-diketone-epoxy resin reaction products blended with monomeric or polymeric phosphonium salts useful for providing corrosion resistance PPG INDUSTRIES, INC. (US) 1982-03-23 US claimed
US-4321305-A Beta-diketone-epoxy resin reaction products useful for providing corrosion resistance PPG INDUSTRIES, INC. (US) 1982-03-23 US claimed
US-20250145823-A1 FOAM-FORMING COMPOSITIONS CONTAINING A METAL CARBOXYLATE CATALYST, RELATED FOAMS AND METHODS FOR THEIR PRODUCTION COVESTRO LLC 2025-05-08 US disclosed
US-12269915-B2 Non aqueous crosslinkable composition ALLNEX NETHERLANDS BV (NL) 2025-04-08 US disclosed
CN-114206972-B Pultrusion process for preparing fiber reinforced polyurethane composites and polyurethane forming reaction mixtures suitable for use in such process 科思创有限公司 2024-11-12 CN disclosed
US-20240279493-A1 NON AQUEOUS CROSSLINKABLE COMPOSITION ALLNEX NETHERLANDS B.V. (NL) 2024-08-22 US disclosed
EP-4077455-B1 NON AQUEOUS CROSSLINKABLE COMPOSITION ALLNEX NETHERLANDS BV (NL) 2024-06-12 EP disclosed
CN-114846049-B Nonaqueous crosslinkable compositions 湛新荷兰有限公司 2024-05-24 CN disclosed
EP-4359482-A1 NON AQUEOUS CROSSLINKABLE COMPOSITION Allnex Netherlands B.V. (NL) 2024-05-01 EP disclosed
US-4571420-A ADDITION POLYMERS WITH UNSATURATED MERCAPTIANS AND VANADIUM COMPUOND ROHM AND HAAS COMPANY (US) 1986-02-18 US disclosed
EP-0102720-A1 Polyurethane coating or adhesive compositions and methods of using them ROHM AND HAAS COMPANY (US) 1984-03-14 EP disclosed
US-4426510-A Polyurethane preparation using organo-zinc catalyst and time-lapse modifier ROHM AND HAAS COMPANY (US) 1984-01-17 US disclosed
US-4321304-A Beta-diketone-epoxy resin reaction products blended with monomeric or polymeric phosphonium salts useful for providing corrosion resistance PPG INDUSTRIES, INC. (US) 1982-03-23 US disclosed
US-4321305-A Beta-diketone-epoxy resin reaction products useful for providing corrosion resistance PPG INDUSTRIES, INC. (US) 1982-03-23 US disclosed
US-4012352-A PARTIALLY CROSSLINKED WITH TETRAVALENT TITANIUM IONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-03-15 US disclosed
US-4009150-A CHELATE COMPOUNDS, REDUCING AGENTS, INITIATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-02-22 US disclosed