SCHEMBL6725846

SCHEMBL6725846

CCCCCCCCCCCCCCCCOc1c(I)cc(C(=O)O)cc1I

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.64
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
ESR1 P03372 1/20 0.55
PLA2G4B P0C869 5/20 0.54
RARB P10826 3/20 0.51
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
PLA2G4A P47712 1/20 0.49
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49

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
SCHEMBL25788122 1.00 PLA2G2A (0.64) PLA2G2ATP53TSHRESR1PLA2G4B
SCHEMBL25788119 1.00 PLA2G2A (0.64) PLA2G2ATP53TSHRESR1PLA2G4B
SCHEMBL25788117 1.00 PLA2G2A (0.64) PLA2G2ATP53TSHRESR1PLA2G4B
SCHEMBL25788113 1.00 PLA2G2A (0.64) PLA2G2ATP53TSHRESR1PLA2G4B
SCHEMBL25789856 0.91 PLA2G2A (0.57) PLA2G2ATP53TSHRESR1PLA2G4B
SCHEMBL6725404 0.84 TPMT (0.45) PLA2G2ATSHRALDH1A1THRATHRB
SCHEMBL1200906 0.82 PLA2G2A (0.66) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL1108059 0.82 PLA2G2A (0.66) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL318045 0.82 PLA2G2A (0.66) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL1200970 0.82 PLA2G2A (0.66) PLA2G2ATP53TSHRPLA2G4BRARB

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