SCHEMBL9525624

SCHEMBL9525624

COc1ccsc1NC(=O)NC1CC2CCC(C1)N2C

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.48
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HTR3A P46098 2/20 0.42
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 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
SCHEMBL9524435 0.81 SMN1; SMN2 (0.48) HTR4MEN1KMT2ALMNAL3MBTL1
SCHEMBL10542205 0.78 POLB (0.60) KMT2AHTR3ALMNAKDM4EALDH1A1
SCHEMBL9525960 0.78 SMN1; SMN2 (0.69) MEN1KMT2AALDH1A1MAPT
SCHEMBL9526020 0.77 HTR4 (0.47) HTR4MEN1KMT2AHTR3ALMNA
SCHEMBL10537786 0.76 MAPT (0.67) HTR4MEN1KMT2AHTR3ALMNA
SCHEMBL10539974 0.75 MAPT (0.56) HTR4MEN1KMT2AHTR3AL3MBTL1
SCHEMBL10540683 0.75 MAPT (0.55) HTR4MEN1KMT2AHTR3ALMNA
SCHEMBL10540979 0.75 TSHR (0.59) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL10539733 0.74 MAPT (0.54) HTR4MEN1KMT2ALMNAKDM4E
SCHEMBL10537855 0.74 KMT2A (0.51) HTR4MEN1KMT2AHTR3ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255297-B1 AZABICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE BEECHAM GROUP PLC (GB) 1993-04-21 EP claimed
EP-0255297-A2 Azabicyclic compounds, process for their preparation, and their pharmaceutical use BEECHAM GROUP PLC (GB) 1988-02-03 EP claimed
EP-0255297-B1 AZABICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE BEECHAM GROUP PLC (GB) 1993-04-21 EP disclosed
US-4808588-A HEADACHES, CENTRAL NERVOUS SYSTEM DISORDERS, ANTIARRHYTHMIA ANTIEMETIC AGENTS BEECHAM GROUP, P.L.C. (GB) 1989-02-28 US disclosed
EP-0255297-A2 Azabicyclic compounds, process for their preparation, and their pharmaceutical use BEECHAM GROUP PLC (GB) 1988-02-03 EP disclosed