SCHEMBL9025520

SCHEMBL9025520

COc1ccc(C)cc1C(N)c1occ2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
NQO1 P15559 1/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
CYP3A4 P08684 1/20 0.36
ACHE P22303 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LPAR1 Q92633 4/20 0.35
GPR84 Q9NQS5 1/20 0.34
MYB P10242 1/20 0.33

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
SCHEMBL9026859 0.87 ADRA2A (0.45) MEN1POLBKMT2ANQO1ALDH1A1
SCHEMBL9025089 0.87 KDM4E (0.41) MEN1KMT2ANQO1ALDH1A1MAPT
SCHEMBL9216019 0.86 NQO1 (0.36) NQO1MAPTACHEGPR84MYB
SCHEMBL9025568 0.86 METAP2 (0.39) METAP2MEN1POLBKMT2ANQO1
SCHEMBL9024896 0.86 MYB (0.36) MEN1POLBKMT2ANQO1MAPT
SCHEMBL9026008 0.86 PKM (0.38) NQO1MAPTACHEGPR84
SCHEMBL9026464 0.83 LTA4H (0.39) MEN1KMT2ANQO1ALDH1A1MAPT
SCHEMBL9026660 0.81 MAPT (0.35) MEN1POLBKMT2ANQO1ALDH1A1
SCHEMBL9032018 0.81 DHFR (0.39) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL9025436 0.80 TSHR (0.39) MEN1POLBKMT2AALDH1A1GAA

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 2 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 disclosed
WO-1995004052-A1 METHYLGUANIDINE DERIVATIVES, METHODS FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1995-02-09 WO disclosed