SCHEMBL6725133

SCHEMBL6725133

CCN(Cc1ccccc1)C(=O)c1cc(I)c(O)c(I)c1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
PPARG P37231 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
LIMK1 P53667 1/20 0.52
LIMK2 P53671 1/20 0.52
ALDH1A1 P00352 4/20 0.50
HPGD P15428 3/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 1/20 0.48
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
OPRD1 P41143 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
SCHEMBL6720857 0.92 KMT2A (0.58) LMNAPPARGTSHRHDAC1HDAC6
SCHEMBL6724972 0.89 PPARG (0.46) LMNAPPARGTSHRMAPK1HDAC1
SCHEMBL1004019 0.84 HDAC1 (0.71) LMNAPPARGTSHRMAPK1HDAC1
SCHEMBL25138742 0.84 HDAC1 (0.71) LMNAPPARGTSHRMAPK1HDAC1
SCHEMBL6725022 0.83 KMT2A (0.69) TSHRHDAC1HDAC6ALDH1A1HPGD
SCHEMBL3455861 0.77 HDAC1 (0.67) LMNAPPARGTSHRMAPK1HDAC1
SCHEMBL3178210 0.76 HDAC1 (0.65) LMNAPPARGTSHRMAPK1HDAC1
SCHEMBL968384 0.76 LMNA (0.72) LMNAPPARGTSHRMAPK1HDAC1
SCHEMBL1195514 0.75 LMNA (0.78) LMNATSHRMAPK1HDAC1HDAC6
SCHEMBL29953564 0.75 HDAC1 (0.59) LMNAPPARGTSHRMAPK1HDAC1

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-6677473-B1 TREATMENT, PREVENTION OR AMELIORATION OF ONE OR MORE SYMPTOMS OF THROMBOTIC DISORDERS, UNSTABLE ANGINA OR CANCER CORVAS INTERNATIONAL INC 2004-01-13 US disclosed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO disclosed