SCHEMBL9307742

SCHEMBL9307742

CCCCCCCCCCCCCCOc1ccc(C(=O)Cl)cc1Cl

nearest known ligand 0.81

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.67
THRB P10828 3/20 0.67
ALDH1A1 P00352 2/20 0.52
HPGD P15428 1/20 0.52
SMPD1 P17405 4/20 0.51
PTPN11 Q06124 1/20 0.51
PLA2G2A P14555 1/20 0.49
S1PR2 O95136 1/20 0.49
S1PR1 P21453 1/20 0.49
S1PR3 Q99500 1/20 0.49
LPAR2 Q9HBW0 1/20 0.49
ATM Q13315 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PLA2G2D Q9UNK4 1/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL11315387 1.00 THRA (0.67) THRATHRBALDH1A1HPGDSMPD1
SCHEMBL9626799 1.00 THRA (0.67) THRATHRBALDH1A1HPGDSMPD1
SCHEMBL9626722 1.00 THRA (0.67) THRATHRBALDH1A1HPGDSMPD1
SCHEMBL11321553 1.00 THRA (0.67) THRATHRBALDH1A1HPGDSMPD1
SCHEMBL9578543 1.00 THRA (0.67) THRATHRBALDH1A1HPGDSMPD1
SCHEMBL11324626 0.98 THRA (0.64) THRATHRBALDH1A1HPGDSMPD1
SCHEMBL11322093 0.94 THRA (0.59) THRATHRBALDH1A1HPGDATM
SCHEMBL9626608 0.90 THRA (0.68) THRATHRBALDH1A1HPGDPTPN11
SCHEMBL11315317 0.90 THRA (0.68) THRATHRBALDH1A1HPGDPTPN11
SCHEMBL18682278 0.90 THRA (0.68) THRATHRBALDH1A1HPGDPTPN11

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-5328921-A Antagonist of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1994-07-12 US disclosed
US-5208247-A Antianaphylactic agents or septic shock AMERICAN CYANAMID COMPANY (US) 1993-05-04 US disclosed
EP-0530444-A1 Aryl, amide, imide, and carbamate pyridine antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1993-03-10 EP disclosed