SCHEMBL8666487

SCHEMBL8666487

CCNC(=O)c1[c]cccc1NC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
HPGD P15428 2/20 0.35
NPC1 O15118 1/20 0.35
CXCR2 P25025 1/20 0.35
KDM4E B2RXH2 3/20 0.34
POLB P06746 1/20 0.34
ATM Q13315 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
BRD4 O60885 3/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACHE P22303 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CYP2C9 P11712 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8667895 0.88 L3MBTL1 (0.42) GAAHPGDKDM4EPOLBADRA1D
SCHEMBL8670976 0.85 TSHR (0.50) HPGDNPC1POLBADRA1DADRA1A
SCHEMBL8669022 0.83 KMT2A (0.46) GAAHPGDNPC1KDM4EPOLB
SCHEMBL8672377 0.83 ALDH1A1 (0.38) GAAHPGDNPC1KDM4EPOLB
SCHEMBL7476442 0.79 ALDH1A1 (0.37) HPGDNPC1KDM4EBRD4KMT2A
SCHEMBL5175506 0.78 KDM4E (0.39) GAAHPGDNPC1KDM4EPOLB
SCHEMBL8672251 0.77 ALDH1A1 (0.38) KDM4EPOLBATMADRA1DADRA1A
SCHEMBL3514319 0.73 CA9 (0.34) GAAHPGDNPC1KDM4EADRA1D
SCHEMBL3478287 0.73 ADRA1D (0.56) GAACXCR2KDM4EPOLBATM
SCHEMBL3515969 0.70 IKBKB (0.36) GAAHPGDNPC1KDM4EL3MBTL1

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-5750552-A ANTIULCER AGENTS ARAX CO., LTD. (JP) 1998-05-12 US disclosed
EP-0736527-A1 Imadazoline derivative, possible tautomer thereof, process of manufacturing therefor, and vulnerary including such derivative or tautomer ARAX CO., LTD. (JP) 1996-10-09 EP disclosed