SCHEMBL6725022

SCHEMBL6725022

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

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.69
MEN1 O00255 2/20 0.69
HPGD P15428 4/20 0.55
ALDH1A1 P00352 3/20 0.55
GAA P10253 1/20 0.55
TSHR P16473 1/20 0.55
HSP90AA1 P07900 1/20 0.54
HTT P42858 1/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
HDAC1 Q13547 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
MAPT P10636 1/20 0.52
MLYCD O95822 1/20 0.52

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 0.87 KMT2A (0.58) KMT2AMEN1TSHRHDAC1HDAC6
SCHEMBL6725133 0.83 LMNA (0.55) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL1003665 0.83 KMT2A (0.83) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL2921609 0.80 KMT2A (0.68) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL28985146 0.79 KMT2A (0.71) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL20338982 0.78 KMT2A (0.65) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL13229125 0.77 KMT2A (0.90) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL3455399 0.77 LIMK2 (0.69) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL2228587 0.76 KMT2A (0.82) KMT2AMEN1HPGDALDH1A1GAA
SCHEMBL18186542 0.76 KMT2A (0.82) KMT2AMEN1HPGDALDH1A1GAA

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