SCHEMBL30901552

SCHEMBL30901552

C=CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC=C

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.63
ALDH1A1 P00352 8/20 0.63
LMNA P02545 2/20 0.63
CYP3A4 P08684 3/20 0.60
MAPK1 P28482 2/20 0.60
TP53 P04637 1/20 0.60
TDP1 Q9NUW8 4/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
HSD17B10 Q99714 3/20 0.51
KDM4E B2RXH2 3/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPC1 O15118 1/20 0.42

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
SCHEMBL30901527 1.00 TSHR (0.63) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL30901572 1.00 TSHR (0.63) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL29220145 1.00 TSHR (0.63) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL29220430 1.00 TSHR (0.63) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL29220152 1.00 TSHR (0.63) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL30901530 1.00 TSHR (0.63) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL29220245 1.00 TSHR (0.63) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL30901565 0.98 TSHR (0.62) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL6513230 0.98 TSHR (0.62) TSHRALDH1A1LMNACYP3A4MAPK1
SCHEMBL6509552 0.94 ALDH1A1 (0.56) TSHRALDH1A1LMNACYP3A4MAPK1

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-118108878-A Organic polymer carrier and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN claimed
CN-118108889-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN claimed
CN-118108889-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN disclosed