SCHEMBL2552984

SCHEMBL2552984

CNC(=O)COc1ccc(C=O)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
POLB P06746 2/20 0.74
FDPS P14324 1/20 0.63
KDM4E B2RXH2 1/20 0.61
TSHR P16473 1/20 0.58
PDE4B Q07343 1/20 0.56
MAPT P10636 3/20 0.55
CYP2C9 P11712 2/20 0.55
LMNA P02545 1/20 0.55
CYP1A2 P05177 1/20 0.55
HSP90AA1 P07900 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL15332128 0.94 ALDH1A1 (0.89) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL2557291 0.87 ALDH1A1 (0.78) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL2558222 0.86 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL29952641 0.86 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL2562497 0.86 ALDH1A1 (0.76) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL2284391 0.85 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL29952092 0.85 POLB (1.00) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL2562135 0.85 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2POLBFDPSKDM4E
SCHEMBL28590760 0.84 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2POLBPDE4BLMNA
SCHEMBL15331508 0.84 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2POLBFDPSKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
CN-107567445-B 2-phenyl-3H-imidazo [4,5-B ] pyridine derivatives useful as inhibitors of mammalian tyrosine kinase ROR1 activity 坎塞拉有限公司 2021-06-29 CN disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed