SCHEMBL692169

SCHEMBL692169

COC(=O)Cc1noc2ccc(S(=O)(=O)Cl)cc12

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
TP53 P04637 6/20 0.43
POLB P06746 2/20 0.43
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.37
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL11204672 0.82 MAPT (0.54) MAPTTP53POLBMEN1KMT2A
SCHEMBL9035469 0.80 MAPT (0.52) MAPTTP53POLBMEN1HTT
SCHEMBL691641 0.77 LMNA (0.39) MAPTTP53POLBLMNASMN1; SMN2
SCHEMBL4378995 0.76 MAPT (0.39) MAPTTP53POLBLMNASMN1; SMN2
SCHEMBL6995111 0.76 SMN1; SMN2 (0.59) MAPTTP53MEN1KMT2ALMNA
SCHEMBL31560851 0.74 MAPT (0.48) MAPTTP53POLBMEN1HTT
SCHEMBL692238 0.73 ALDH1A1 (0.36) MAPTTP53KMT2ALMNASMN1; SMN2
SCHEMBL18470230 0.72 MTNR1A (0.47) MAPTTP53POLBMEN1HTT
SCHEMBL692261 0.72 BRD4 (0.46) KMT2A
SCHEMBL14564360 0.72 MAPT (0.56) MAPTTP53POLBMEN1HTT

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-2422780-A1 Resistance-repellent retroviral protease inhibitors Sequoia Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
EP-2422781-A1 Resistance-repellent retroviral protease inhibitors Sequoia Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed