SCHEMBL17424944

SCHEMBL17424944

COC(=O)c1cccc(O)c1CBr

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
TSHR P16473 1/20 0.59
CA1 P00915 5/20 0.53
CA2 P00918 5/20 0.53
CA9 Q16790 5/20 0.53
CA12 O43570 4/20 0.53
CA7 P43166 4/20 0.53
CA14 Q9ULX7 4/20 0.53
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 2/20 0.44
CFTR P13569 1/20 0.44
CA5A P35218 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 3/20 0.43
POLB P06746 2/20 0.43
ATM Q13315 1/20 0.43
PDK2 Q15119 1/20 0.43
PDK4 Q16654 1/20 0.43
GLA P06280 1/20 0.41
EGFR P00533 1/20 0.41

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
SCHEMBL29041518 0.89 LMNA (0.52) LMNATSHRCA1CA2CA9
SCHEMBL2655486 0.84 LMNA (0.61) LMNATSHRCA1CA2CA9
SCHEMBL5839700 0.83 ALDH1A1 (0.53) LMNATSHRCA1CA2CA9
SCHEMBL436238 0.83 LMNA (0.46) LMNATSHRCA1CA2CA9
SCHEMBL30041782 0.83 LMNA (0.46) LMNATSHRCA1CA2CA9
SCHEMBL3540201 0.83 ALDH1A1 (0.47) LMNATSHRCA1CA2CA9
SCHEMBL25361016 0.81 ALDH1A1 (0.61) LMNATSHRCA1CA2CA9
SCHEMBL5557509 0.81 LMNA (0.44) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL3538611 0.81 ALDH1A1 (0.51) LMNATSHRCA1CA2CA9
SCHEMBL1585790 0.81 LMNA (0.44) LMNATSHRCA1CA2CA9

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
WO-2023088245-A1 DEGRADATION AGENT AND USE THEREOF 成都先导药物开发股份有限公司 2023-05-25 WO disclosed
EP-2463269-B1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex INTREXON CORP (US) 2016-09-28 EP disclosed
EP-2460786-B1 Bioavailable diacylhydrazine ligands for modulating the expression of exogenous genes via an ecdysone receptor complex INTREXON CORP (US) 2016-01-13 EP disclosed