SCHEMBL28075596

SCHEMBL28075596

CCCOC(=O)CCC(=O)OCCC.COC(=O)CCCC(=O)OC

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.62
DGKA P23743 1/20 0.55
DNM1 Q05193 1/20 0.46
ALDH1A1 P00352 2/20 0.44
USP2 O75604 1/20 0.44
HTR2C P28335 1/20 0.44
ADRA2A P08913 1/20 0.43
ADRA1A P35348 1/20 0.43
EPHX2 P34913 1/20 0.42
TOP2A P11388 1/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BLM P54132 1/20 0.42
MAPK1 P28482 1/20 0.42
CA12 O43570 1/20 0.42
CA14 Q9ULX7 1/20 0.42
PAM P19021 2/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL5271388 0.98 TSHR (0.65) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL5267637 0.94 DGKA (0.63) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL775807 0.94 TSHR (0.62) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL28075597 0.93 TSHR (0.68) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL20564222 0.92 DGKA (0.67) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL20563366 0.92 DGKA (0.67) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL5269195 0.92 DGKA (0.67) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL5271805 0.92 DGKA (0.67) TSHRDGKADNM1ALDH1A1USP2
SCHEMBL19638 0.89 DGKA (0.67) TSHRDGKADNM1ALDH1A1HTR2C
Propyl Pentadecanoate SCHEMBL28237355 0.88 DGKA (0.74) TSHRDGKADNM1ALDH1A1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104150808-B For improving the method and additive of construction composition and substrate adherence 阿克佐诺贝尔化学国际公司 2017-11-17 CN disclosed
CN-103687830-B Method and additive for improving adhesion of a composition to a substrate 阿克佐诺贝尔化学国际公司 2016-08-17 CN disclosed