SCHEMBL6721162

SCHEMBL6721162

O=C(c1cc(I)c(O)c(I)c1)c1cc(I)c(OCc2cccc(I)c2)c(I)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.46
IDO1 P14902 2/20 0.43
TTR P02766 6/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.40
BIRC5 O15392 1/20 0.40
ABCB11 O95342 1/20 0.40
PGR P06401 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
DRD1 P21728 1/20 0.40
TBXA2R P21731 1/20 0.40
PTGS1 P23219 1/20 0.40
SLC6A2 P23975 1/20 0.40
PDE4A P27815 1/20 0.40
ADORA1 P30542 1/20 0.40
OPRM1 P35372 1/20 0.40
DRD3 P35462 1/20 0.40
SLC6A3 Q01959 1/20 0.40

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
SCHEMBL6725044 0.92 F2 (0.46) F2IDO1LMNAHPGDMRGPRX4
SCHEMBL4265967 0.85 F2 (0.49) F2IDO1MEN1KMT2AMRGPRX4
SCHEMBL6721262 0.83 IDO1 (0.42) F2IDO1LMNAHPGDSLC26A3
SCHEMBL4276277 0.78 THRA (0.47) F2IDO1LMNAHPGDABCB11
SCHEMBL6724848 0.77 IDO1 (0.44) F2IDO1SLC26A3
SCHEMBL6724979 0.76 SRD5A2 (0.58) HPGDMEN1KMT2AMRGPRX4
SCHEMBL4271148 0.76 THRA (0.57) PGRTHRATHRB
SCHEMBL6723591 0.75 THRA (0.46) LMNAHPGDSLC6A2SLC6A3KMT2A
SCHEMBL4275299 0.74 MAOB (0.53) F2MEN1KMT2AMRGPRX4THRA
SCHEMBL6723744 0.74 THRA (0.43) F2IDO1PGRTHRATHRB

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