SCHEMBL8883465

SCHEMBL8883465

CC1CC(C)(C)C(=O)C1=Cc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
PIM1 P11309 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
AKR1C3 P42330 2/20 0.38
GSK3B P49841 1/20 0.38
AKR1C1 Q04828 1/20 0.38
MYC P01106 1/20 0.38
NAT1 P18440 1/20 0.38
MAX P61244 1/20 0.38
NR1I2 O75469 1/20 0.38
SIGMAR1 Q99720 1/20 0.37
NPC1 O15118 2/20 0.35
MAPT P10636 2/20 0.35
RAB9A P51151 2/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
NFKB1 P19838 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
SCHEMBL8883780 1.00 KDM4E (0.55) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8883464 1.00 KDM4E (0.55) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8757417 0.84 KDM4E (0.48) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8757631 0.84 KDM4E (0.48) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8881476 0.81 KDM4E (0.45) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8883477 0.81 KDM4E (0.45) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8881480 0.81 KDM4E (0.45) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8883480 0.81 KDM4E (0.45) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL9027659 0.79 ALDH1A1 (0.52) KDM4EALDH1A1PIM1PIM2MEN1
SCHEMBL8882806 0.76 KDM4E (0.46) KDM4EALDH1A1PIM1PIM2MEN1

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
US-5639918-A Intermediate compounds useful in the preparation of fungicidal compositions containing (benzylidene)-azolylmethyclycloalkane RHONE-POULENC AGROCHIMIE (FR) 1997-06-17 US disclosed
CN-1031971-C (Benzylidene)-azolylmethylcycloalkane and use as fungicide RHONE POULENC AGROCHIMIE (FR) 1996-06-12 CN disclosed
EP-0378953-B1 Benzylidene azolyl methyl cycloalkane and its use as a fungicide RHONE POULENC AGROCHIMIE (FR) 1996-06-05 EP disclosed
US-5380743-A Fungicidal compositions containing (benzylidene)-azolymethylcycloalkane RHONE-POULENC AGROCHIMIE (FR) 1995-01-10 US disclosed
US-5256683-A Plant protective agent 1H-1,2,4-triazolylmethylcycloalkane or -alkene benzylidene RHONE-POULENC AGROCHIMIE (FR) 1993-10-26 US disclosed
EP-0378953-A1 Benzylidene azolyl methyl cycloalkane and its use as a fungicide RHONE-POULENC AGROCHIMIE (FR) 1990-07-25 EP disclosed