SCHEMBL30294036

SCHEMBL30294036

CCCCCCCCCCCCCCCc1ccc(OC(=O)CCCC(=O)Oc2ccc(CCCCCCCCCCCCCCC)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.64
THRA P10827 5/20 0.64
KMT2A Q03164 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
FAAH O00519 1/20 0.53
ALDH1A1 P00352 4/20 0.51
ESR1 P03372 2/20 0.51
ADRA2A P08913 2/20 0.51
ADORA3 P0DMS8 2/20 0.51
TACR2 P21452 2/20 0.51
SLC6A2 P23975 2/20 0.51
SLC6A4 P31645 2/20 0.51
SLC6A3 Q01959 2/20 0.51
LMNA P02545 2/20 0.51
CYP3A4 P08684 2/20 0.51
KDM4E B2RXH2 1/20 0.51
SHBG P04278 1/20 0.51
TP53 P04637 1/20 0.51
HSPD1 P10809 1/20 0.51
ADRB3 P13945 1/20 0.51

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
SCHEMBL7927891 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL27503643 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL7930191 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL28748404 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL10620500 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL24372243 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL27503295 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL28805567 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL2885452 0.97 THRB (0.64) THRBTHRAKMT2ASMN1; SMN2FAAH
SCHEMBL28313951 0.95 THRB (0.62) THRBTHRAKMT2ASMN1; SMN2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112661867-B Modified starch and preparation method and application thereof 瑞辰星生物技术(广州)有限公司 2023-04-07 CN disclosed