SCHEMBL30013629

SCHEMBL30013629

CCCCCCCCCCCC=CC=CC(=O)N1CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
FASN P49327 1/20 0.49
CNR1 P21554 2/20 0.47
CNR2 P34972 2/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL30013635 1.00 KDM4E (0.49) KDM4EFASNCNR1CNR2MEN1
SCHEMBL30013641 1.00 KDM4E (0.49) KDM4EFASNCNR1CNR2MEN1
SCHEMBL17091589 1.00 KDM4E (0.49) KDM4EFASNCNR1CNR2MEN1
SCHEMBL17091590 1.00 KDM4E (0.49) KDM4EFASNCNR1CNR2MEN1
SCHEMBL29785744 0.98 KDM4E (0.48) KDM4EFASNCNR1CNR2MEN1
SCHEMBL31174386 0.98 KDM4E (0.48) KDM4EFASNCNR1CNR2MEN1
(2E,4Z-Decadienoyl)Piperidine SCHEMBL4881424 0.98 L3MBTL1 (0.47) KDM4EFASNCNR1CNR2MEN1
(2E,4Z-Decadienoyl)Piperidine SCHEMBL989745 0.98 L3MBTL1 (0.47) KDM4EFASNCNR1CNR2MEN1
(2E,4Z-Decadienoyl)Piperidine SCHEMBL989746 0.98 L3MBTL1 (0.47) KDM4EFASNCNR1CNR2MEN1
(2E,4Z-Decadienoyl)Hexamethleneimine SCHEMBL990447 0.98 L3MBTL1 (0.47) KDM4EFASNCNR1CNR2MEN1

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
EP-4100034-A1 COMPOSITIONS COMPRISING EXTRACTS OF APLINIA AND OTHER PLANTS FOR IMPROVING JOINT HEALTH AND TREATING ARTHRITIS Unigen, Inc. (US) 2022-12-14 EP disclosed