SCHEMBL9527006

SCHEMBL9527006

CCOC(=O)CC(=O)N1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.54
MGAM O43451 1/20 0.52
GAA P10253 1/20 0.52
SI P14410 1/20 0.52
MGAM2 Q2M2H8 1/20 0.52
PRKCA P17252 1/20 0.50
GSK3B P49841 1/20 0.50
POLB P06746 3/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 4/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.44
ATM Q13315 2/20 0.44

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
SCHEMBL11191103 1.00 ALOX15 (0.54) ALOX15MGAMGAASIMGAM2
SCHEMBL11191041 0.98 ALOX15 (0.56) ALOX15MGAMGAASIMGAM2
SCHEMBL7008562 0.83 ALOX15 (0.47) ALOX15MGAMGAASIMGAM2
SCHEMBL12496081 0.83 ALOX15 (0.53) ALOX15MGAMGAASIMGAM2
SCHEMBL5203267 0.83 ALOX15 (0.53) ALOX15MGAMGAASIMGAM2
SCHEMBL8176741 0.81 ALOX15 (0.51) ALOX15MGAMGAASIMGAM2
SCHEMBL223339 0.81 ALOX15 (0.51) ALOX15MGAMGAASIMGAM2
SCHEMBL17025473 0.81 ALOX15 (0.51) ALOX15MGAMGAASIMGAM2
SCHEMBL3707572 0.81 LMNA (0.73) ALOX15MGAMGAASIMGAM2
SCHEMBL20558262 0.80 GAA (0.52) ALOX15MGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0252474-B1 HYDRAZINE DERIVATIVES AMERICAN CYANAMID COMPANY (US) 1993-04-21 EP disclosed
EP-0525832-A1 Substituted 1,2,3- thiadiazole-4-thiolates AMERICAN CYANAMID COMPANY (US) 1993-02-03 EP disclosed
US-4916237-A Substituted 1,2,3-thiadiazole-4-thiolates AMERICAN CYANAMID COMPANY (US) 1990-04-10 US disclosed
US-4803280-A Substituted 1,2,3-thia-diazole-4-thiolates AMERICAN CYANAMID COMPANY (US) 1989-02-07 US disclosed
EP-0252474-A2 Hydrazine derivatives AMERICAN CYANAMID COMPANY (US) 1988-01-13 EP disclosed
US-4407797-A ANTIULCER AGENT RHONE-POULENC SANTE (FR) 1983-10-04 US disclosed