SCHEMBL6728507

SCHEMBL6728507

O=C(COc1c(I)cc(C(=O)c2cc(I)c(O)c(I)c2)cc1I)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
HPGD P15428 3/20 0.49
ALDH1A1 P00352 3/20 0.49
THRB P10828 6/20 0.47
THRA P10827 5/20 0.47
ELANE P08246 2/20 0.43
GAA P10253 1/20 0.42
NPC1 O15118 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RAB9A P51151 1/20 0.40
NSD2 O96028 1/20 0.39
LMNA P02545 3/20 0.39
TTR P02766 3/20 0.39
EYA3 Q99504 2/20 0.39
PGR P06401 2/20 0.39
HTR1A P08908 2/20 0.39
TBXA2R P21731 2/20 0.39

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
SCHEMBL6820149 0.92 MEN1 (0.43) MEN1KMT2AHPGDALDH1A1THRB
SCHEMBL6725936 0.85 GAA (0.40) MEN1KMT2AHPGDALDH1A1THRB
SCHEMBL6723591 0.82 THRA (0.46) KMT2AHPGDALDH1A1THRBTHRA
SCHEMBL6725180 0.80 THRB (0.55) MEN1KMT2AALDH1A1THRBTHRA
SCHEMBL6725083 0.80 ESR1 (0.49) MEN1KMT2AHPGDALDH1A1ELANE
SCHEMBL6728497 0.76 THRA (0.61) MEN1KMT2AALDH1A1THRBTHRA
SCHEMBL6723918 0.76 ALDH1A1 (0.47) KMT2AALDH1A1THRBTHRATDP1
SCHEMBL6721180 0.74 ALDH1A1 (0.43) MEN1KMT2AHPGDALDH1A1THRB
SCHEMBL6731605 0.74 ALDH1A1 (0.45) KMT2AHPGDALDH1A1THRBTHRA
SCHEMBL6724871 0.73 THRA (0.57) KMT2ATHRBTHRAELANEKDM4E

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 3 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-2003009871-A2 INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR FOR DECREASING BODY MASS GENSET S.A. (FR) 2003-02-06 WO disclosed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO disclosed