SCHEMBL10405754

SCHEMBL10405754

O=C(O)c1ccc2c(c1)CC(NS(=O)(=O)c1ccccc1)C2

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APOB P04114 4/20 0.57
MTTP P55157 4/20 0.57
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NR1H2 P55055 6/20 0.50
HDAC8 Q9BY41 4/20 0.50
HDAC6 Q9UBN7 2/20 0.50
TBXA2R P21731 1/20 0.50
NR1H3 Q13133 1/20 0.49
PSEN1 P49768 2/20 0.48
PSEN2 P49810 2/20 0.48
APH1B Q8WW43 2/20 0.48
NCSTN Q92542 2/20 0.48
APH1A Q96BI3 2/20 0.48
PSENEN Q9NZ42 2/20 0.48

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
SCHEMBL10405919 0.89 ALDH1A1 (0.61) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL10405720 0.85 APOB (0.51) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL10405769 0.84 MEN1 (0.52) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL10405772 0.84 MEN1 (0.52) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL5822058 0.82 PSEN1 (0.65) APOBMTTPMEN1KMT2APSEN1
SCHEMBL10405664 0.81 NR1H2 (0.48) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL10406159 0.81 APOB (0.48) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL4733742 0.80 NR1H2 (0.55) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL10406586 0.80 TBXA2R (0.65) APOBMTTPMEN1KMT2ANR1H2
SCHEMBL7760828 0.80 PSEN1 (0.71) APOBMTTPMEN1KMT2ANR1H2

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
US-4929754-A CARDIOVASCULAR DISORDERS, ANTICOAGULANTS, ANTITUMOR AGENTS DR. KARL THOMAE GMBH (DE) 1990-05-29 US disclosed
US-4820705-A ANTITUMOR, CARDIOVASCULR DISORDERS DR. KARL THOMAE GMBH (DE) 1989-04-11 US disclosed