SCHEMBL11370596

SCHEMBL11370596

COc1ccc(OCC(O)CN2CCN(C(N)=O)CC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.67
POLB P06746 2/20 0.67
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
MAPT P10636 3/20 0.62
L3MBTL1 Q9Y468 2/20 0.61
MAPK1 P28482 1/20 0.61
GLA P06280 1/20 0.60
USP2 O75604 1/20 0.60
TSHR P16473 1/20 0.60
ATM Q13315 1/20 0.56
ABCB1 P08183 2/20 0.55

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
SCHEMBL11377484 0.90 USP2 (0.77) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL11362587 0.88 MAPT (0.60) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL11372226 0.88 TP53 (0.71) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL11371054 0.88 MAPT (0.54) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL4578208 0.88 KDM4E (0.85) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL11370338 0.87 KCNH2 (0.68) KDM4EKMT2AMAPTMAPK1GLA
SCHEMBL11367331 0.87 MEN1 (0.54) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL11378959 0.87 L3MBTL1 (0.74) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL11368552 0.86 KMT2A (0.70) KDM4EPOLBMEN1KMT2AMAPT
SCHEMBL11365440 0.84 TSHR (0.70) KDM4EPOLBMEN1KMT2AMAPT

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
US-4269838-A ADRENERGIC BLOCKING AGENTS; ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS NIPPON SHINYAKU CO. LTD. (JP) 1981-05-26 US claimed
US-4269838-A ADRENERGIC BLOCKING AGENTS; ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS NIPPON SHINYAKU CO. LTD. (JP) 1981-05-26 US disclosed