SCHEMBL7963380

SCHEMBL7963380

NC(=O)[N]CCCN1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
KEAP1 Q14145 1/20 0.50
KDM4E B2RXH2 4/20 0.48
LMNA P02545 2/20 0.47
GLA P06280 1/20 0.46
MAPK1 P28482 1/20 0.45
HIF1A Q16665 1/20 0.45
HPGD P15428 1/20 0.42
DUSP3 P51452 1/20 0.42
ALDH1A1 P00352 2/20 0.42
PAOX Q6QHF9 1/20 0.42
RAB9A P51151 1/20 0.41
HSD17B10 Q99714 1/20 0.40
EPHX1 P07099 1/20 0.39

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
SCHEMBL7976883 0.89 KDM4E (0.52) GAASMN1; SMN2KEAP1KDM4ELMNA
SCHEMBL6477465 0.78 HRH3 (0.49) SMN1; SMN2LMNAMAPK1ALDH1A1
SCHEMBL1358701 0.77 KDM4E (0.61) GAASMN1; SMN2KEAP1KDM4ELMNA
Hydrochloric Acid SCHEMBL11543248 0.76 GLA (0.60) GAASMN1; SMN2KEAP1KDM4ELMNA
SCHEMBL8616993 0.76 KDM4E (0.59) GAASMN1; SMN2KEAP1KDM4ELMNA
SCHEMBL5980656 0.75 SMN1; SMN2 (0.54) GAASMN1; SMN2KEAP1KDM4ELMNA
Sulfuric Acid SCHEMBL11724660 0.75 BLM (0.47) GAASMN1; SMN2KEAP1KDM4ELMNA
SCHEMBL5910714 0.74 KEAP1 (0.58) GAASMN1; SMN2KEAP1KDM4ELMNA
SCHEMBL5843494 0.74 KDM4E (0.57) GAASMN1; SMN2KEAP1KDM4ELMNA
SCHEMBL1726737 0.74 KDM4E (0.57) GAASMN1; SMN2KEAP1KDM4ELMNA

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-8288380-B2 Thiophenediamine derivative having urea structure SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-10-16 US disclosed
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed