SCHEMBL19971110

SCHEMBL19971110

CCCCC(CC)CC1(C(N)=O)CCCC1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.36
CA1 P00915 2/20 0.35
ALDH1A1 P00352 4/20 0.34
TDP1 Q9NUW8 2/20 0.34
TSHR P16473 4/20 0.33
CYP3A4 P08684 3/20 0.33
ATM Q13315 1/20 0.33
CYP2D6 P10635 2/20 0.31
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
CHRM1 P11229 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
OPRM1 P35372 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 1/20 0.31
KCNH2 Q12809 1/20 0.31
LMNA P02545 3/20 0.30

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
SCHEMBL28421670 0.83 CA2 (0.33) CA2CA1ALDH1A1TDP1TSHR
SCHEMBL6983852 0.75 SIRT2 (0.33) CA2CA1LMNACA12CA3
Formamide SCHEMBL28230408 0.74 ALDH1A1 (0.35) CA2ALDH1A1TDP1TSHRCYP3A4
SCHEMBL28692921 0.73 ALDH1A1 (0.34) ALDH1A1TDP1TSHRCYP3A4CYP2D6
SCHEMBL11131328 0.71 CA2 (0.41) CA2CA1ALDH1A1TDP1TSHR
SCHEMBL6060679 0.67 SIRT2 (0.38) MEN1KMT2A
SCHEMBL16909338 0.67 CA2 (0.33) CA2ALDH1A1TDP1TSHRCYP3A4
SCHEMBL3360175 0.66 CA2 (0.42) CA2CA1ALDH1A1TDP1TSHR
SCHEMBL10523972 0.65 CA2 (0.44) CA2CA1ALDH1A1TDP1TSHR
SCHEMBL30538382 0.65 CA2 (0.44) CA2CA1ALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111133018-B Activators for promoted adhesion build SIKA技术股份公司 2022-05-24 CN disclosed
CN-108368233-B Two-component polyurethane composition SIKA技术股份公司 2022-02-08 CN disclosed
CN-107428941-B Amidino group-containing catalyst SIKA技术股份公司 2020-11-24 CN disclosed
EP-3688052-A1 ACTIVATOR FOR ACCELERATED ADHESION DEVELOPMENT Sika Technology AG (CH) 2020-08-05 EP disclosed
CN-107735438-B Guanidino-containing catalysts SIKA技术股份公司 2020-06-09 CN disclosed
CN-111133018-A Activators for promoted adhesion build SIKA技术股份公司 2020-05-08 CN disclosed
EP-3294803-A1 CATALYST CONTAINING GUANIDINE GROUPS Sika Technology AG (CH) 2018-03-21 EP disclosed