SCHEMBL3265953

SCHEMBL3265953

Cc1c(Cl)c(=O)oc2cc(OP(=O)(O)OCCCl)ccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.62
ALDH1A1 P00352 6/20 0.62
HPGD P15428 6/20 0.62
CA12 O43570 3/20 0.62
CA1 P00915 3/20 0.62
CA4 P22748 3/20 0.62
CA5A P35218 3/20 0.62
CA7 P43166 3/20 0.62
CA5B Q9Y2D0 3/20 0.62
CA3 P07451 1/20 0.62
CYP3A4 P08684 1/20 0.62
CA6 P23280 1/20 0.62
CA9 Q16790 1/20 0.62
CA13 Q8N1Q1 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
CA14 Q9ULX7 1/20 0.62
GAA P10253 4/20 0.58
HSD17B10 Q99714 2/20 0.58
USP2 O75604 1/20 0.57
GLA P06280 1/20 0.57

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
Haloxon SCHEMBL167194 0.88 KDM4E (0.65) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL4104045 0.82 KDM4E (0.65) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL38663564 0.81 KDM4E (0.70) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL4104048 0.81 KDM4E (0.70) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL669657 0.80 KDM4E (0.77) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL1953258 0.80 KDM4E (0.56) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL12549576 0.80 KDM4E (0.56) KDM4EALDH1A1HPGDCA12CA1
Coumaphos SCHEMBL9812694 0.79 KDM4E (0.89) KDM4EALDH1A1HPGDCA12CA1
Coumaphos SCHEMBL9812699 0.79 KDM4E (0.93) KDM4EALDH1A1HPGDCA12CA1
Coumaphos SCHEMBL9283960 0.77 KDM4E (1.00) KDM4EALDH1A1HPGDCA12CA1

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
EP-1611246-B1 MEDIUM FOR THE DETECTION AND IDENTIFICATION OF MICRO-ORGANISMS BIOMERIEUX SA (FR) 2010-06-02 EP claimed
EP-1611246-B1 MEDIUM FOR THE DETECTION AND IDENTIFICATION OF MICRO-ORGANISMS BIOMERIEUX SA (FR) 2010-06-02 EP disclosed