SCHEMBL9801567

SCHEMBL9801567

CC1(C)CN(CCCO)CCO1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.32
KEAP1 Q14145 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PAOX Q6QHF9 1/20 0.30
GRM2 Q14416 1/20 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
SCHEMBL2073495 0.89 KDM4E (0.45) KDM4EALDH1A1GRM2
SCHEMBL11135474 0.83 S1PR1 (0.38) ALDH1A1KEAP1SMN1; SMN2
SCHEMBL16732804 0.81 KEAP1 (0.31) KEAP1SMN1; SMN2
SCHEMBL9801655 0.81 KEAP1 (0.52) KEAP1SMN1; SMN2GRM2
SCHEMBL1515408 0.81 KEAP1 (0.31) KEAP1SMN1; SMN2
SCHEMBL5597011 0.80 S1PR1 (0.43) ALDH1A1
SCHEMBL1515594 0.80 KDM4E (0.37) KDM4EALDH1A1TSHRKEAP1SMN1; SMN2
SCHEMBL16943590 0.79 GBA1 (0.34)
SCHEMBL22282220 0.79 MAPK1 (0.34) KDM4EALDH1A1TSHR
SCHEMBL4550374 0.79 KDM4E (0.33) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118525043-A Expandable protective coating 恒科温托斯有限公司 2024-08-20 CN claimed
CN-117255814-A Catechol-containing film material 米塞尔聚合物公司 2023-12-19 CN disclosed
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed