SCHEMBL25367145

SCHEMBL25367145

CCOC(=O)c1cc2cccc(OC)c2nc1Cl

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44

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
SCHEMBL1883218 0.87 HPGDS (0.48) KMT2APOLBMAPTSMN1; SMN2KDM4E
SCHEMBL22902557 0.85 MEN1 (0.47) MEN1KMT2APOLBMAPTLMNA
SCHEMBL26617853 0.83 TSHR (0.46) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL22902660 0.81 MAPT (0.47) MEN1KMT2APOLBMAPTLMNA
SCHEMBL4714235 0.79 CNR2 (0.49) MEN1KMT2APOLBLMNAKDM4E
SCHEMBL12014805 0.77 NQO2 (0.51) MEN1KMT2APOLBMAPTLMNA
SCHEMBL2203793 0.77 ALDH1A1 (0.54) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL30923332 0.77 ALDH1A1 (0.54) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL29799082 0.76 KDM4E (0.54) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL28590535 0.76 KDM4E (0.54) MEN1KMT2AMAPTKDM4EALDH1A1

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
CN-114423757-B Tricyclic heteroaryl compounds useful as IRAK4 inhibitors 百时美施贵宝公司 2024-07-02 CN disclosed
EP-3999508-B1 TRICYCLIC HETEROARYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-08-30 EP disclosed
CN-114423757-A Tricyclic heteroaryl compounds useful as IRAK4 inhibitors 百时美施贵宝公司 2022-04-29 CN disclosed