SCHEMBL19975255

SCHEMBL19975255

COc1ccccc1C(=O)NCC(O)C(=O)NCc1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.56
TP53 P04637 1/20 0.56
GLA P06280 1/20 0.56
APEX1 P27695 1/20 0.55
ALDH1A1 P00352 1/20 0.51
MAPT P10636 1/20 0.51
LMNA P02545 3/20 0.49
PDE10A Q9Y233 1/20 0.49
POLB P06746 2/20 0.49
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
ATM Q13315 1/20 0.48
GRM5 P41594 1/20 0.47
KCNA3 P22001 1/20 0.47
CTSD P07339 1/20 0.47
CHRM3 P20309 1/20 0.47

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
SCHEMBL28498838 0.88 HPGD (0.72) HPGDTP53GLAAPEX1ALDH1A1
SCHEMBL29809770 0.88 HPGD (0.72) HPGDTP53GLAAPEX1ALDH1A1
SCHEMBL19974733 0.84 CTSD (0.48) APEX1ALDH1A1MAPTLMNAPDE10A
SCHEMBL28404148 0.77 HPGD (0.74) HPGDTP53GLAALDH1A1LMNA
SCHEMBL29936750 0.77 HPGD (0.74) HPGDTP53GLAALDH1A1LMNA
SCHEMBL19974682 0.76 CTSD (0.51) APEX1ALDH1A1MAPTLMNAPDE10A
SCHEMBL19975254 0.76 CTSD (0.47) APEX1ALDH1A1MAPTLMNAPDE10A
SCHEMBL19974969 0.75 MAPT (0.51) APEX1ALDH1A1MAPTLMNAPDE10A
SCHEMBL13040229 0.74 HPGD (0.74) HPGDTP53GLAAPEX1ALDH1A1
SCHEMBL18641776 0.74 HPGD (0.74) HPGDTP53GLAAPEX1ALDH1A1

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-3512836-A1 ANTIVIRAL COMPOUNDS Haplogen GmbH (AT) 2019-07-24 EP disclosed
WO-2018050631-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2018-03-22 WO disclosed