SCHEMBL1867368

SCHEMBL1867368

COc1ccc(-c2c(C)nn3c(O)c4c(nc23)CCC4)c(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 16/20 0.68
MAPT P10636 3/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
MAPK1 P28482 2/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL2403511 0.91 CRHR1 (0.67) CRHR1MAPTALDH1A1HPGDMAPK1
SCHEMBL1868622 0.90 CRHR1 (0.70) CRHR1MAPTALDH1A1HPGDMAPK1
SCHEMBL13117470 0.84 CRHR1 (0.69) CRHR1MAPTALDH1A1HPGDMAPK1
SCHEMBL13139632 0.84 CRHR1 (0.68) CRHR1
SCHEMBL13117478 0.83 CRHR1 (0.70) CRHR1
SCHEMBL2403097 0.82 CRHR1 (0.67) CRHR1MAPTALDH1A1HPGDMAPK1
SCHEMBL2401221 0.82 CRHR1 (0.74) CRHR1
SCHEMBL2403821 0.82 CRHR1 (0.66) CRHR1
SCHEMBL2403009 0.82 CRHR1 (0.66) CRHR1
SCHEMBL2404350 0.81 CRHR1 (0.63) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947697-B1 8-(3-pentylamino)-2-methyl-3-(2-chloro-4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[d] pyrazolo[1,5-a]pyrimidine methanesulfonate as a CRF antagonist ONO PHARMACEUTICAL CO., LTD. (JP) 2011-05-24 US disclosed
US-7947697-B1 8-(3-pentylamino)-2-methyl-3-(2-chloro-4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[d] pyrazolo[1,5-a]pyrimidine methanesulfonate as a CRF antagonist ONO PHARMACEUTICAL CO., LTD. (JP) 2011-05-24 US disclosed
US-7947697-B1 8-(3-pentylamino)-2-methyl-3-(2-chloro-4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[d] pyrazolo[1,5-a]pyrimidine methanesulfonate as a CRF antagonist ONO PHARMACEUTICAL CO., LTD. (JP) 2011-05-24 US disclosed
EP-1637531-B1 METHANESULFONIC ACID SALT OF PYRAZOLOPYRIMIDINE COMPOUND, CRYSTAL THEREOF, AND PROCESS FOR PRODUCING THE SAME ONO PHARMACEUTICAL CO (JP) 2010-08-25 EP disclosed
EP-1637531-B1 METHANESULFONIC ACID SALT OF PYRAZOLOPYRIMIDINE COMPOUND, CRYSTAL THEREOF, AND PROCESS FOR PRODUCING THE SAME ONO PHARMACEUTICAL CO (JP) 2010-08-25 EP disclosed
EP-1637531-A1 METHANESULFONIC ACID SALT OF PYRAZOLOPYRIMIDINE COMPOUND, CRYSTAL THEREOF, AND PROCESS FOR PRODUCING THE SAME ONO PHARMACEUTICAL CO., LTD. (JP) 2006-03-22 EP disclosed