SCHEMBL30483153

SCHEMBL30483153

CC(C)C(C(C)C)N(c1ccc(N(C)[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)cc1)[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
MAPT P10636 2/20 0.55
APAF1 O14727 1/20 0.55
POLB P06746 1/20 0.55
RECQL P46063 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
MPO P05164 1/20 0.49
TSHR P16473 1/20 0.49
BLM P54132 1/20 0.49
PMP22 Q01453 1/20 0.49
KMT2A Q03164 1/20 0.49
HIF1A Q16665 1/20 0.49
ACE P12821 2/20 0.47
DNMT1 P26358 1/20 0.47
ECE1 P42892 1/20 0.46
TACR1 P25103 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL21411535 0.88 KDM4E (0.63) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL538983 0.79 KDM4E (0.61) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL29787090 0.79 KDM4E (0.64) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL29212821 0.79 KDM4E (0.68) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL3855611 0.79 KDM4E (0.68) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL3855614 0.79 KDM4E (0.68) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL31018783 0.78 KDM4E (0.63) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL22384094 0.78 KDM4E (0.67) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL31018781 0.78 KDM4E (0.63) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL839528 0.77 KDM4E (0.68) KDM4EMAPTAPAF1POLBRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4456900-A1 RESPIRATORY STIMULANT PARENTERAL FORMULATIONS Enalare Therapeutics Inc. (US) 2024-11-06 EP disclosed
WO-2023129502-A1 RESPIRATORY STIMULANT PARENTERAL FORMULATIONS ENALARE THERAPEUTICS INC. (US) 2023-07-06 WO disclosed