SCHEMBL9025568

SCHEMBL9025568

COc1ccc(Cl)cc1C(N)c1occ2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 1/20 0.39
NQO1 P15559 1/20 0.36
LPAR1 Q92633 2/20 0.36
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ADORA2A P29274 1/20 0.35
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 1/20 0.34
IGF1R P08069 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ACHE P22303 1/20 0.34
GPR84 Q9NQS5 1/20 0.34

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
SCHEMBL9032014 0.88 MAPT (0.36) METAP2MEN1KMT2ANPC1POLB
SCHEMBL9026040 0.88 HTR2C (0.39) MEN1KMT2APOLBSLC6A2SLC6A4
SCHEMBL9025682 0.86 HTR2C (0.36) MEN1KMT2ANPC1POLBL3MBTL1
SCHEMBL9026859 0.86 ADRA2A (0.45) MEN1KMT2ANPC1POLBNQO1
SCHEMBL9025520 0.86 METAP2 (0.38) METAP2MEN1KMT2APOLBNQO1
SCHEMBL9025089 0.86 KDM4E (0.41) MEN1KMT2ANPC1NQO1RAB9A
SCHEMBL9024896 0.85 MYB (0.36) MEN1KMT2ANPC1POLBNQO1
SCHEMBL9026008 0.85 PKM (0.38) NQO1SLC6A2SLC6A4MAPTACHE
SCHEMBL9216019 0.85 NQO1 (0.36) NQO1MAPTACHEGPR84
SCHEMBL9025817 0.85 LPAR1 (0.36) METAP2MEN1KMT2ANPC1POLB

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-0711290-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1996-05-15 EP claimed
WO-1995004052-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1995-02-09 WO claimed
EP-0711290-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1996-05-15 EP disclosed
WO-1995004052-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1995-02-09 WO disclosed