SCHEMBL28658992

SCHEMBL28658992

CCCCCOC(=O)C(C(=O)OCCCCC)(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
CYP3A4 P08684 4/20 0.56
TP53 P04637 1/20 0.56
MAPK1 P28482 1/20 0.56
LMNA P02545 4/20 0.54
ALDH1A1 P00352 2/20 0.54
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 2/20 0.48
HSD17B10 Q99714 2/20 0.48
POLB P06746 1/20 0.48
CYP2D6 P10635 3/20 0.47
PPARG P37231 3/20 0.47
RAB9A P51151 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
SCN1A P35498 2/20 0.47
SCN2A Q99250 2/20 0.47
SCN3A Q9NY46 2/20 0.47

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
SCHEMBL28558105 0.95 TSHR (0.54) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL28648216 0.91 TSHR (0.48) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL28668236 0.88 LMNA (0.55) TSHRCYP3A4LMNAALDH1A1KDM4E
SCHEMBL28647851 0.86 TSHR (0.46) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL31147063 0.85 TSHR (0.54) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL31147056 0.84 TSHR (0.53) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL5709937 0.84 MEN1 (0.61) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL5709848 0.84 MEN1 (0.61) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL5668363 0.84 TSHR (0.53) TSHRCYP3A4TP53MAPK1LMNA
SCHEMBL27815598 0.84 MEN1 (0.61) TSHRCYP3A4TP53MAPK1LMNA

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-118909171-A Solid catalyst component for olefin polymerization reaction, preparation method and application thereof 中国石油化工股份有限公司 2024-11-08 CN claimed
CN-118909171-A Solid catalyst component for olefin polymerization reaction, preparation method and application thereof 中国石油化工股份有限公司 2024-11-08 CN disclosed
CN-109678997-B Catalyst component and catalyst for olefin polymerization, prepolymerized catalyst and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed