SCHEMBL6720945

SCHEMBL6720945

O=C(O)c1cc(I)c(OCc2ccc(F)cc2)c(I)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.59
PPARA Q07869 7/20 0.51
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
KDM5A P29375 1/20 0.47
KDM2B Q8NHM5 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
MAOB P27338 3/20 0.47
PARP10 Q53GL7 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PTGER1 P34995 1/20 0.46
ALKBH1 Q13686 1/20 0.45

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
SCHEMBL4265171 0.88 RXRA (0.62) NR4A2PPARARXRARXRBMEN1
SCHEMBL4269670 0.86 MEN1 (0.63) NR4A2RXRARXRBMEN1KMT2A
SCHEMBL6731785 0.85 NR4A2 (0.59) NR4A2PPARARXRARXRBKDM5A
SCHEMBL4274343 0.85 RXRA (0.59) PPARARXRARXRBKDM5AKDM5B
SCHEMBL4278599 0.85 THRA (0.50) RXRARXRBKDM5AKDM2BKDM4C
SCHEMBL6725141 0.84 RXRA (0.55) NR4A2PPARARXRARXRBKDM5A
SCHEMBL4267556 0.84 NR4A2 (0.64) NR4A2PPARAKDM5AKDM5BMAOB
SCHEMBL17916639 0.83 NR4A2 (0.60) NR4A2PPARARXRARXRBKMT2A
SCHEMBL6725214 0.82 MRGPRX4 (0.57) NR4A2PPARARXRARXRBMEN1
SCHEMBL29319558 0.81 RXRA (0.62) NR4A2RXRARXRB

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