SCHEMBL7847522

SCHEMBL7847522

O=C(O)Cc1ccc(C(=O)CCCl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.50
CAMK2A Q9UQM7 1/20 0.50
AKR1B1 P15121 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.47
LMNA P02545 2/20 0.47
ABCC4 O15439 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
PTGS1 P23219 1/20 0.47
HTT P42858 1/20 0.47
MAPT P10636 1/20 0.46
SRD5A2 P31213 2/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
KMT2A Q03164 1/20 0.44
NR4A2 P43354 1/20 0.44
ANPEP P15144 1/20 0.43
ENPEP Q07075 1/20 0.43
FFAR1 O14842 2/20 0.43
KDM4E B2RXH2 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
SCHEMBL3672575 0.89 CA2 (0.47) CA2CAMK2AAKR1B1L3MBTL1LMNA
SCHEMBL4902972 0.80 L3MBTL1 (0.59) L3MBTL1LMNAGAAMAPTRAB9A
SCHEMBL14218974 0.80 ALDH1A1 (0.45) CA2L3MBTL1GAAMAPTRAB9A
SCHEMBL1577530 0.79 CA2 (0.58) CA2CAMK2AAKR1B1L3MBTL1LMNA
SCHEMBL11374661 0.79 RAB9A (0.59) L3MBTL1LMNAMAPTRAB9ANPC1
SCHEMBL10708487 0.79 MAPT (0.56) L3MBTL1LMNATSHRMAPTRAB9A
SCHEMBL5866548 0.78 ALDH1A1 (0.55) L3MBTL1HTTMAPTRAB9ANPC1
SCHEMBL4819030 0.78 CES2 (0.50) CA2L3MBTL1GAAMAPTRAB9A
SCHEMBL11007778 0.78 IDO1 (0.41) CA2L3MBTL1GAAMAPTRAB9A
SCHEMBL11108413 0.78 CA2 (0.56) CA2CAMK2AAKR1B1L3MBTL1LMNA

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-0820455-B1 5H, 10H-IMIDAZO [1,2-a]INDENO [1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES AVENTIS PHARMA SA (FR) 2001-10-31 EP disclosed
US-6057454-A USEFUL FOR TREATING OR PREVENTING ALL ISCHAEMIAS (SUCH AS FOCAL OR GLOBAL ISCHAEMIA) RESULTING FROM CEREBROVASCULAR DISORDERS RHONE-POULENC RORER S.A. (FR) 2000-05-02 US disclosed
EP-0820455-A1 5H, 10H-IMIDAZO [1,2-a]INDENO [1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES Aventis Pharma S.A. (FR) 1998-01-28 EP disclosed
WO-1996031511-A1 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1996-10-10 WO disclosed