SCHEMBL11836367

SCHEMBL11836367

CC1(C)CCc2cc(O)cc(C(C)(C)C)c2O1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 6/20 0.47
LMNA P02545 2/20 0.36
NR1I2 O75469 3/20 0.35
MALT1 Q9UDY8 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2C9 P11712 1/20 0.33
MIF P14174 1/20 0.33
TYR P14679 1/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
NFE2L2 Q16236 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX5 P09917 4/20 0.33

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
SCHEMBL4462887 0.84 AKT1 (0.44) AKT1LMNANR1I2ALDH1A1CYP2C9
SCHEMBL13423096 0.81 MALT1 (0.33) AKT1MALT1NFE2L2
SCHEMBL30439741 0.79 AKT1 (0.57) AKT1LMNANR1I2ALOX5
SCHEMBL2483669 0.79 AKT1 (0.57) AKT1LMNANR1I2ALOX5
SCHEMBL22412614 0.78 AKT1 (0.58) AKT1LMNANR1I2MALT1ALOX5
SCHEMBL10460194 0.73 PTGS1 (0.49) AKT1LMNANR1I2ALDH1A1CYP2C9
SCHEMBL5775188 0.73 CYP1A2 (0.36) AKT1LMNAMALT1ALDH1A1ALOX15
SCHEMBL12401786 0.72 PPARA (0.34)
SCHEMBL1151712 0.72 ALOX15 (0.42) LMNANR1I2ALDH1A1CYP2C9MIF
Phenol SCHEMBL28710851 0.71 AKT1 (0.51) AKT1LMNANR1I2MALT1ALOX5

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-3951664-A Light-sensitive material having developers embedded therein AGFA-GEVAERT, A.G. (DT) 1976-04-20 US disclosed
US-3933507-A LIGHT INSENSITIVE SILVER SALT, POLYMETHINE SENSITIZER AGFA-GEVAERT, A.G. (DT) 1976-01-20 US disclosed