SCHEMBL5349652

SCHEMBL5349652

CCCCCc1[nH]c(CCCCC)c2c1CCCC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
HPGD P15428 4/20 0.54
KDM4E B2RXH2 4/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
LMNA P02545 4/20 0.37
GAA P10253 3/20 0.37
MAPT P10636 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
NPC1 O15118 3/20 0.35
SLC2A1 P11166 3/20 0.35
RAB9A P51151 3/20 0.35
PAX8 Q06710 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTT P42858 1/20 0.35
NTSR1 P30989 1/20 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
SCHEMBL891089 0.70 TYMP (0.46) ALDH1A1HPGDKDM4EMAPTTSHR
SCHEMBL95750 0.69 MEN1 (0.44) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL24016772 0.69 MEN1 (0.49) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL2360239 0.68 TYMP (0.44) ALDH1A1HPGDKDM4EMAPTTSHR
SCHEMBL678379 0.67 MEN1 (0.42) ALDH1A1KDM4ECYP1A2KMT2AMEN1
SCHEMBL7733127 0.67 MEN1 (0.42) ALDH1A1KDM4ECYP1A2KMT2AMEN1
SCHEMBL5468812 0.67 MEN1 (0.42) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL5472185 0.67 MEN1 (0.42) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL7739138 0.67 MEN1 (0.42) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL677747 0.67 MEN1 (0.42) ALDH1A1KDM4ECYP1A2KMT2AMEN1

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-2007129169-A2 COX- II INHIBITORS FOR IMPROVING REPRODUCTIVE SUCCESS IN A FEMALE ANIMAL PFIZER LIMITED (GB) 2007-11-15 WO disclosed