SCHEMBL7478156

SCHEMBL7478156

COc1ccc(OCc2ccccc2)c2c1CN(Nc1ccncc1)CC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.42
LMNA P02545 3/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
USP2 O75604 1/20 0.41
MAPK1 P28482 3/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ROCK1 Q13464 1/20 0.39
F2 P00734 2/20 0.38

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
SCHEMBL7475383 0.82 KMT2A (0.46) CHRNA7LMNAKDM4EALDH1A1TSHR
SCHEMBL7477683 0.82 CHRNA7 (0.62) CHRNA7LMNAKDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL7481541 0.81 MEN1 (0.39) CHRNA7LMNAKDM4EALDH1A1TSHR
SCHEMBL7476937 0.78 CYP19A1 (0.42) LMNAKDM4EALDH1A1MEN1MAPT
SCHEMBL7487024 0.78 ALDH1A1 (0.38) ALDH1A1MEN1KMT2APTGDR2
SCHEMBL7477780 0.78 DRD1 (0.36) ALDH1A1TSHRMEN1KMT2AHTR1A
Hydrochloric Acid SCHEMBL7480606 0.78 DRD1 (0.36) ALDH1A1TSHRMEN1KMT2AHTR1A
Fumaric Acid SCHEMBL7481233 0.77 MEN1 (0.47) KDM4EALDH1A1HSD17B10MEN1GAA
Fumaric Acid SCHEMBL7481240 0.77 MEN1 (0.47) KDM4EALDH1A1HSD17B10MEN1GAA
SCHEMBL7482205 0.75 DRD2 (0.46)

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 7 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 claimed
EP-0950056-A2 N-(PYRIDINYLAMINO)ISOINDOLINES AND RELATED COMPOUNDS HOECHST MARION ROUSSEL, INC. (US) 1999-10-20 EP claimed
WO-1998029407-A2 N-(PYRIDINYLAMINO)ISOINDOLINES FOR TREATING ALZHEIMER'S AND DEPRESSION HOECHST MARION ROUSSEL, INC. (US) 1998-07-09 WO claimed
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