SCHEMBL5086676

SCHEMBL5086676

Cc1c2oc(=O)cc(C)c2c(C)c2c(CCl)coc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PON1 P27169 2/20 0.47
KDM4E B2RXH2 6/20 0.44
KMT2A Q03164 3/20 0.44
MAPK1 P28482 2/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 5/20 0.43
HSD17B10 Q99714 3/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 2/20 0.42
HPGD P15428 2/20 0.40
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.37
KCNA3 P22001 2/20 0.36
MAOA P21397 2/20 0.36
ALDH2 P05091 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
HTR2C P28335 1/20 0.36
ADORA2A P29274 1/20 0.36

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
SCHEMBL3939905 0.86 KDM4E (0.43) PON1KDM4EKMT2AMAPK1ALDH1A1
SCHEMBL4229673 0.86 KDM4E (0.43) PON1KDM4EKMT2AMAPK1ALDH1A1
SCHEMBL8947878 0.85 PON1 (0.42) PON1KDM4EKMT2AMAPK1RAB9A
Hydrochloric Acid SCHEMBL1002717 0.84 KDM4E (0.42) PON1KDM4EKMT2AMAPK1ALDH1A1
SCHEMBL7869275 0.83 KDM4E (0.43) PON1KDM4EKMT2AMAPK1ALDH1A1
SCHEMBL9058002 0.81 KDM4E (0.47) PON1KDM4EKMT2AMAPK1RAB9A
SCHEMBL4975144 0.78 KDM4E (0.37) PON1KDM4EKMT2AMAPK1ALDH1A1
SCHEMBL8011917 0.78 KDM4E (0.37) PON1KDM4EKMT2AMAPK1ALDH1A1
SCHEMBL8014647 0.76 KDM4E (0.36) KDM4EKMT2AMAPK1ALDH1A1HSD17B10
SCHEMBL9443604 0.76 KDM1A (0.37) KDM4EKMT2AALDH1A1HSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080138802-A1 Gene Detection Method and Gene Detection Apparatus PANASONIC CORPORATION (JP) 2008-06-12 US disclosed
EP-1757935-A1 GENE DETECTION METHOD AND GENE DETECTION APPARATUS Matsushita Electric Industries Co., Ltd. (JP) 2007-02-28 EP disclosed
WO-1989007606-A1 PARTLY SINGLE-STRANDED AND PARTLY DOUBLE-STRANDED NUCLEIC ACID PROBE AND PROCESS FOR PRODUCING IT MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WISSENSC (DE) 1989-08-24 WO disclosed