SCHEMBL26481706

SCHEMBL26481706

Cc1ccnc(OCCOCCOCCN)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOX P28300 1/20 0.41
▸ LOXL2 Q9Y4K0 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NOS3 P29474 1/20 0.40
▸ NOS1 P29475 1/20 0.40
▸ NOS2 P35228 1/20 0.40
▸ MAPK1 P28482 2/20 0.38
▸ UHRF1 Q96T88 1/20 0.38
▸ CCR1 P32246 1/20 0.38
▸ CCR5 P51681 1/20 0.38
▸ CCR8 P51685 1/20 0.38
▸ CRHR1 P34998 3/20 0.35
▸ RXRA P19793 4/20 0.35
▸ GRIN1 Q05586 4/20 0.35
▸ GRIN2B Q13224 4/20 0.35
▸ CDK5 Q00535 2/20 0.35
▸ CDK5R1 Q15078 2/20 0.35
▸ MAPT P10636 3/20 0.35

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
SCHEMBL8352772 0.90 LOXL2 (0.46) LOXLOXL2KDM4EMEN1KMT2A
SCHEMBL16065098 0.83 MAPK1 (0.38) KDM4EMEN1KMT2ANOS3NOS1
SCHEMBL16065068 0.80 KDM4E (0.35) LOXLOXL2KDM4EMAPK1CDK5
SCHEMBL12017658 0.79 UHRF1 (0.43) LOXLOXL2KDM4EMEN1KMT2A
SCHEMBL17707978 0.79 UHRF1 (0.43) LOXLOXL2KDM4EMEN1KMT2A
SCHEMBL16065266 0.77 SMN1; SMN2 (0.38) LOXLOXL2KDM4EMEN1KMT2A
SCHEMBL16065100 0.77 DUT (0.39) LOXLOXL2KDM4EMEN1KMT2A
SCHEMBL129040 0.77 CRHR1 (0.46) LOXLOXL2KDM4EMEN1KMT2A
SCHEMBL10187322 0.75 CRHR1 (0.44) LOXLOXL2KDM4EMEN1KMT2A
SCHEMBL12017657 0.75 KMT2A (0.44) LOXLOXL2KDM4EMEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023191953-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE UNIVERSITY OF RHODE ISLAND BOARD OF TRUSTEES (US) 2023-10-05 — — WO disclosed
Send feedback