SCHEMBL30748709

SCHEMBL30748709

COCCOCCOCCOCCNC(=O)CCCC(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
HPGD P15428 2/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RECQL P46063 1/20 0.40
CNR1 P21554 1/20 0.40
TLR2 O60603 1/20 0.38
TLR1 Q15399 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
EPHX2 P34913 1/20 0.37
KDM4E B2RXH2 3/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
GLA P06280 1/20 0.35
POLB P06746 1/20 0.35
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA12 O43570 1/20 0.33

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
SCHEMBL14117979 0.96 TSHR (0.47) TSHRHPGDHTTSMN1; SMN2RECQL
SCHEMBL803737 0.90 TSHR (0.42) TSHRHPGDHTTSMN1; SMN2RECQL
SCHEMBL13225385 0.90 TSHR (0.42) TSHRHPGDHTTSMN1; SMN2RECQL
SCHEMBL29467640 0.90 TSHR (0.42) TSHRHPGDHTTSMN1; SMN2RECQL
SCHEMBL23565968 0.89 TSHR (0.43) TSHRHPGDHTTSMN1; SMN2RECQL
SCHEMBL30594267 0.89 TSHR (0.41) TSHRRECQLCNR1TLR2TLR1
SCHEMBL30293683 0.89 TDP1 (0.45) TSHRTLR2TLR1MEN1KMT2A
SCHEMBL29975223 0.87 TLR2 (0.41) TSHRRECQLTLR2TLR1MEN1
SCHEMBL23051843 0.87 TSHR (0.41) TSHRRECQLCNR1TLR2TLR1
SCHEMBL16167796 0.84 GAA (0.45) TSHRSMN1; SMN2RECQLTLR2TLR1

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-117279662-A Branched linkers for antibody-drug conjugates and methods of use thereof R.P.谢勒技术有限责任公司 2023-12-22 CN disclosed