SCHEMBL5030862

SCHEMBL5030862

C=C(C)C(=O)OCCOC(=O)c1cccc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.53
CDC25B P30305 2/20 0.52
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 4/20 0.49
HPGD P15428 3/20 0.49
MAPT P10636 1/20 0.49
ADRB2 P07550 2/20 0.48
ADRB1 P08588 2/20 0.48
ADRB3 P13945 2/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 2/20 0.47
DRD3 P35462 1/20 0.47
CDC25A P30304 1/20 0.46
CDC25C P30307 1/20 0.46
CACNA1B Q00975 2/20 0.45
APBA1 Q02410 2/20 0.45
NR4A1 P22736 1/20 0.44
NR4A2 P43354 1/20 0.44

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
SCHEMBL19360469 0.93 HRH3 (0.56) HRH3CDC25BALDH1A1KDM4EHPGD
SCHEMBL18904535 0.89 CDC25B (0.52) HRH3CDC25BALDH1A1KDM4EHPGD
SCHEMBL14001888 0.87 TSHR (0.45) HRH3CDC25BALDH1A1KDM4EHPGD
SCHEMBL129437 0.86 TSHR (0.62) ALDH1A1HPGDPOLBTSHRTDP1
SCHEMBL786986 0.86 CDC25B (0.61) HRH3CDC25BALDH1A1KDM4EHPGD
SCHEMBL26312591 0.86 TSHR (0.47) HRH3ALDH1A1KDM4EPOLBKMT2A
SCHEMBL14440784 0.85 HRH3 (0.58) HRH3CDC25BALDH1A1KDM4EHPGD
SCHEMBL28996621 0.85 TSHR (0.61) ALDH1A1HPGDPOLBTSHRTDP1
SCHEMBL14001887 0.84 TSHR (0.43) HRH3CDC25BALDH1A1KDM4EMAPT
SCHEMBL10040387 0.84 CDC25B (0.46) HRH3CDC25BALDH1A1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930954-A Cationic polymer microsphere and preparation method thereof 中国科学技术大学 2025-05-06 CN disclosed
US-20170153547-A1 COATING COMPOSITIONS FOR USE WITH AN OVERCOATED PHOTORESIST DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-06-01 US disclosed
US-7459263-B2 Optical recording media with triplet-sensitized isomerization EASTMAN KODAK COMPANY (US) 2008-12-02 US disclosed
US-7459263-B2 Optical recording media with triplet-sensitized isomerization EASTMAN KODAK COMPANY (US) 2008-12-02 US disclosed
US-7459263-B2 Optical recording media with triplet-sensitized isomerization EASTMAN KODAK COMPANY (US) 2008-12-02 US disclosed
US-20050136357-A1 Optical recording media with triplet-sensitzed isomerization FPC INC. 2005-06-23 US disclosed