SCHEMBL17414239

SCHEMBL17414239

OCc1cc(F)ccc1C(Cl)(Cl)Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.33
CYP3A4 P08684 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KIF11 P52732 1/20 0.33
NR3C2 P08235 4/20 0.32
NR3C1 P04150 3/20 0.32
P2RX7 Q99572 1/20 0.32
CA3 P07451 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
RIPK1 Q13546 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31

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
SCHEMBL17414238 0.86 IDO1 (0.42) IDO1NR3C2NR3C1P2RX7CA3
SCHEMBL5823911 0.82 CYP3A4 (0.34) IDO1CYP3A4TSHRMAPK1TDP1
SCHEMBL21403423 0.82 IDO1 (0.46) IDO1KIF11P2RX7SLC6A2SLC6A4
SCHEMBL29875850 0.82 IDO1 (0.46) IDO1KIF11P2RX7SLC6A2SLC6A4
SCHEMBL13547861 0.80 PTGS1 (0.40) IDO1NR3C2NR3C1SLC6A2SLC6A4
SCHEMBL2625769 0.73 IDO1 (0.42) IDO1NR3C2NR3C1SLC6A2SLC6A4
SCHEMBL3309883 0.73 IDO1 (0.40) IDO1CA3CA6CA5ACA9
SCHEMBL31085527 0.73 IDO1 (0.40) IDO1CA3CA6CA5ACA9
SCHEMBL17696933 0.72 CA3 (0.50) IDO1CYP3A4TSHRMAPK1TDP1
SCHEMBL31529917 0.72 IDO1 (0.36) IDO1KIF11CA3CA6CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9856732-B2 Tracers RESTRACK AS (NO) 2018-01-02 US disclosed
EP-2935508-B1 TRACERS RESTRACK AS (NO) 2017-02-15 EP disclosed
US-20160003040-A1 Tracers Resman Technology AS (NO) 2016-01-07 US disclosed
US-20160003040-A1 Tracers Resman Technology AS (NO) 2016-01-07 US disclosed