SCHEMBL8866071

SCHEMBL8866071

OCCCCc1ncc(Cl)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.40
KDM4E B2RXH2 1/20 0.33
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
KCNJ5 P48544 1/20 0.32
KCNJ3 P48549 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL22493741 0.80 PLAU (0.46) PLAU
SCHEMBL8865864 0.79 PLAU (0.43) PLAUKDM4ESMN1; SMN2
SCHEMBL23706067 0.77 PLAU (0.43) PLAU
SCHEMBL31091988 0.77 PLAU (0.43) PLAU
SCHEMBL31168516 0.75 S100A9 (0.38) PLAUCYP11B1CYP11B2KCNJ5KCNJ3
SCHEMBL31168519 0.75 S100A9 (0.38) PLAUCYP11B1CYP11B2KCNJ5KCNJ3
SCHEMBL20188949 0.74 PLAU (0.43) PLAUSMN1; SMN2
SCHEMBL25224414 0.74 PLAU (0.43) PLAUSMN1; SMN2
SCHEMBL30481308 0.74 PLAU (0.43) PLAUSMN1; SMN2
SCHEMBL19534297 0.72 PLAU (0.46) PLAU

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5436344-A 3-bromo-5-chloro-pyridines used as intermediates in the synthesis of azatetralones PFIZER INC. (US) 1995-07-25 US claimed
US-5677458-A Method of preparing azatetralones PFIZER INC. (US) 1997-10-14 US disclosed
US-5608071-A Synthesis of 3-bromo-5-chloro-2-alkyl-pyridine derivatives PFIZER INC. (US) 1997-03-04 US disclosed
US-5436344-A 3-bromo-5-chloro-pyridines used as intermediates in the synthesis of azatetralones PFIZER INC. (US) 1995-07-25 US disclosed