SCHEMBL28535945

SCHEMBL28535945

CC(C)N(c1ccc(Cl)cc1)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ADRB2 P07550 1/20 0.42
LMNA P02545 1/20 0.42
CYP2A6 P11509 1/20 0.42
TAAR1 Q96RJ0 2/20 0.40
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
CES1 P23141 1/20 0.38
RORC P51449 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
USP2 O75604 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 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
SCHEMBL20438385 0.86 ALDH1A1 (0.39) ALDH1A1ALOX15HSD17B10TDP1CYP3A4
SCHEMBL5018098 0.79 TYR (0.41) ALDH1A1KDM4ELMNA
SCHEMBL16021810 0.79 ADRB2 (0.48) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL12304286 0.78 ALDH1A1 (0.35) ALDH1A1KDM4EALOX15HSD17B10TDP1
SCHEMBL20438389 0.78 SMN1; SMN2 (0.37) ALDH1A1ALOX15HSD17B10LMNARORC
SCHEMBL5301480 0.77 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL819703 0.76 ALDH1A1 (0.50) ALDH1A1LMNACES1TDP1CA12
SCHEMBL6650120 0.75 CHRNB2 (0.41) ALDH1A1ADRB2LMNATAAR1SLC6A2
SCHEMBL6030612 0.74 ESR1 (0.46) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL18386540 0.74 APP (0.41) ALDH1A1KDM4ETAAR1CES1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117337310-A Composition based on (meth) acrylate monomers and zinc salts 博斯蒂克股份公司 2024-01-02 CN disclosed
CN-116472297-A Two-component adhesive compositions based on itaconate monomers 博斯蒂克股份公司 2023-07-21 CN disclosed
CN-114729231-A Compositions made from (meth) acrylate monomers 波士胶公司 2022-07-08 CN disclosed
CN-112912454-A Reworkable adhesive composition 汉高股份有限及两合公司 2021-06-04 CN disclosed
CN-112437797-A Flame retardant adhesive composition 汉高股份有限及两合公司 2021-03-02 CN disclosed