SCHEMBL25196576

SCHEMBL25196576

CCCCC(CC)Cc1c(CN)cccc1CN

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP3A4 P08684 5/20 0.38
CA2 P00918 2/20 0.38
KDM4E B2RXH2 1/20 0.37
TSHR P16473 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
GLA P06280 1/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 2/20 0.35
OPRM1 P35372 2/20 0.34
OPRD1 P41143 2/20 0.34
OPRK1 P41145 2/20 0.34
OPRL1 P41146 2/20 0.34
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
PNMT P11086 1/20 0.32
BDKRB2 P30411 1/20 0.32
TLR8 Q9NR97 1/20 0.32

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
SCHEMBL22289762 0.88 ALDH1A1 (0.41) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL22774066 0.84 ALDH1A1 (0.43) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL411185 0.81 ALDH1A1 (0.39) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL29352100 0.80 LMNA (0.42) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL28161302 0.79 ALDH1A1 (0.37) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL153633 0.78 ALDH1A1 (0.47) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL29385746 0.78 ALDH1A1 (0.47) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL2066167 0.78 LMNA (0.45) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL6269825 0.78 ALDH1A1 (0.36) ALDH1A1TDP1CYP3A4CA2KDM4E
SCHEMBL19465365 0.77 ALDH1A1 (0.41) ALDH1A1TDP1CYP3A4CA2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4186938-A1 EPOXY RESIN COMPOSITION HAVING ADJUSTABLE CURING RATE AT DIFFERENT TEMPERATURES Sika Technology AG (CH) 2023-05-31 EP disclosed