SCHEMBL30396359

SCHEMBL30396359

O=Cc1ccc(Cl)cc1OC1CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
ERN1 O75460 2/20 0.42
POLB P06746 1/20 0.40
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
SLC6A4 P31645 4/20 0.37
RORC P51449 1/20 0.37
HTR6 P50406 1/20 0.37
GRIK1 P39086 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
SCHEMBL24190659 1.00 TDP1 (0.48) TDP1ERN1POLBHTR2CHTR2B
SCHEMBL3663943 0.92 TDP1 (0.44) TDP1ERN1POLBSLC6A4HTR6
SCHEMBL14784352 0.81 ERN1 (0.44) TDP1ERN1POLBHTR2CHTR2B
SCHEMBL7662729 0.80 POLB (0.45) TDP1ERN1POLBSLC6A4HTR6
SCHEMBL29333351 0.79 POLB (0.47) ERN1POLBSLC6A4HTR6
SCHEMBL29952250 0.79 POLB (0.40) POLBRORC
SCHEMBL275626 0.79 POLB (0.44) TDP1ERN1POLBSLC6A4HTR6
SCHEMBL20570322 0.77 KMT2A (0.46) TDP1ERN1
SCHEMBL274642 0.76 ERN1 (0.40) TDP1ERN1HTR2CHTR2B
SCHEMBL275979 0.76 CHEK1 (0.42) TDP1ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4165037-A1 ANTI-VIRAL COMPOUNDS FOR TREATING CORONAVIRUS, PICORNAVIRUS, AND NOROVIRUS INFECTIONS Aligos Therapeutics, Inc. (US) 2023-04-19 EP disclosed