SCHEMBL8830552

SCHEMBL8830552

Cn1c(=O)cc(Cl)n(-c2ccccc2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 4/20 0.50
GSK3B P49841 4/20 0.50
PGR P06401 1/20 0.47
CYP3A4 P08684 1/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.40
NAPRT Q6XQN6 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
GAA P10253 1/20 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
SCHEMBL1419534 0.83 GSK3A (0.45) GSK3AGSK3BCYP3A4KMT2AMEN1
SCHEMBL15766434 0.79 CYP1A2 (0.48) CYP3A4KMT2AMEN1TSHRGAA
SCHEMBL8581675 0.79 CYP3A4 (0.55) GSK3AGSK3BPGRCYP3A4KMT2A
SCHEMBL22887339 0.79 GSK3A (0.41) GSK3AGSK3BCYP3A4KMT2AMEN1
SCHEMBL8830654 0.79 MAPT (0.57) GSK3AGSK3BPGRCYP3A4KMT2A
SCHEMBL30284816 0.78 ALDH1A1 (0.40) GSK3AGSK3BKMT2AKDM4ETSHR
SCHEMBL11443153 0.76 KMT2A (0.53) GSK3AGSK3BPGRKMT2AMEN1
SCHEMBL8830707 0.76 KMT2A (0.53) GSK3AGSK3BPGRKMT2AMEN1
SCHEMBL22421647 0.75 KMT2A (0.51) GSK3AGSK3BPGRCYP3A4KMT2A
SCHEMBL5199351 0.74 GSK3B (0.71) GSK3AGSK3BPGRKMT2AMAPK1

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-3193878-B1 7,8-DIHYDRO-[2H]-IMIDAZO-[1,2-A]PYRAZOLO[4,3-E]PYRIMIDIN-4(5H)-ONE DERIVATIVES AS PHOSPHODIESTERASE 1 (PDE1) INHIBITORS FOR TREATING DISEASES, DISORDERS OR INJURIES OF THE CENTRAL NERVOUS SYSTEM (CNS) INTRA CELLULAR THERAPIES INC (US) 2021-01-06 EP disclosed
EP-3725789-A1 7,8-DIHYDRO-[2H]-IMIDAZO-[1,2-A]PYRAZOLO[4,3-E]PYRIMIDIN-4(5H)-ONE DERIVATIVES AS PHOSPHODIESTERASE 1 (PDE1) INHIBITORS FOR TREATING DISEASES, DISORDERS OR INJURIES OF THE CENTRAL NERVOUS SYSTEM (CNS) Intra-Cellular Therapies, Inc. (US) 2020-10-21 EP disclosed
US-5661153-A FOR TREATING ALLERGIES, ASTHMA, DERMATITIS, GRAFT REJECTIONS JAPAN ENERGY CORPORATION (JP) 1997-08-26 US disclosed
EP-0700908-A1 1-Arylpyrimidine derivatives and pharmaceutical use thereof JAPAN ENERGY CORPORATION (JP) 1996-03-13 EP disclosed