SCHEMBL7477683

SCHEMBL7477683

COc1cc2c(cc1OCc1ccccc1)CCN(Nc1ccncc1)C2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.62
REV1 Q9UBZ9 1/20 0.52
GPR183 P32249 1/20 0.48
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
MEN1 O00255 1/20 0.44
PDE4B Q07343 1/20 0.44
HTR1A P08908 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR7 P34969 1/20 0.43
HTR2B P41595 1/20 0.43
GPR84 Q9NQS5 1/20 0.43
ABCB1 P08183 2/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL7478156 0.82 CHRNA7 (0.42) CHRNA7KMT2ANPC1MEN1HTR1A
SCHEMBL7478927 0.82 HRH3 (0.56) CHRNA7REV1
SCHEMBL7483471 0.81 CHRNA7 (0.44) CHRNA7NPC1PDE4BKDM4EUSP2
SCHEMBL3041638 0.81 REV1 (0.74) CHRNA7REV1KMT2APDE4BABCB1
Hydrochloric Acid SCHEMBL7480209 0.81 CHRNA7 (0.44) CHRNA7KMT2AMEN1PDE4BKDM4E
SCHEMBL7476993 0.79 DRD3 (0.52) KMT2AMEN1PDE4BKDM4E
SCHEMBL7478486 0.79 KMT2A (0.47) KMT2AMEN1PDE4BHTR2CHTR2B
Hydrochloric Acid SCHEMBL7474283 0.78 DRD3 (0.51) KMT2AMEN1PDE4BKDM4E
SCHEMBL7475383 0.77 KMT2A (0.46) CHRNA7REV1KMT2ANPC1MEN1
SCHEMBL21255938 0.77 CHRNA7 (1.00) CHRNA7REV1GPR183KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0950056-B1 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP disclosed
US-6004977-A ANTIDEPRESSANTS, COGNITION ACTIVATORS, AND ALZHEIMER'S DISEASE TREATMENT HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed
EP-0950056-A2 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS HOECHST MARION ROUSSEL, INC. (US) 1999-10-20 EP disclosed
WO-1998029407-A2 N-(PYRIDINYLAMINO)ISOINDOLINES FOR TREATING ALZHEIMER'S AND DEPRESSION HOECHST MARION ROUSSEL, INC. (US) 1998-07-09 WO disclosed