SCHEMBL3977294

SCHEMBL3977294

COCCCOc1cc(CBr)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
REN P00797 5/20 0.35
BIRC5 O15392 1/20 0.35
SLC6A4 P31645 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL3071677 0.84 CYP4F2 (0.54) L3MBTL1TDP1CYP4F2CYP4A11REN
SCHEMBL3073300 0.84 TTR (0.40) L3MBTL1TDP1CYP4F2CYP4A11REN
SCHEMBL3979694 0.82 TSHR (0.41) L3MBTL1TDP1RENBIRC5SLC6A4
SCHEMBL1039963 0.82 REN (0.48) L3MBTL1TDP1REN
SCHEMBL3081718 0.82 SLC6A4 (0.50) L3MBTL1TDP1RENBIRC5SLC6A4
SCHEMBL7954853 0.81 TAAR1 (0.42) TDP1ALDH1A1
SCHEMBL3977128 0.81 L3MBTL1 (0.43) L3MBTL1TDP1CYP4F2CYP4A11REN
SCHEMBL3239988 0.80 PPARG (0.36) L3MBTL1RENSLC6A4
SCHEMBL1596908 0.80 KDM4E (0.43) L3MBTL1TDP1SLC6A4KDM4EALDH1A1
SCHEMBL3077526 0.79 BIRC5 (0.47) L3MBTL1TDP1RENBIRC5ALDH1A1

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
WO-2009053277-A1 ASPARTYL PROTEASE INHIBITORS MEDIVIR AB (SE) 2009-04-30 WO disclosed
WO-2009053277-A1 ASPARTYL PROTEASE INHIBITORS MEDIVIR AB (SE) 2009-04-30 WO disclosed
WO-2008107365-A1 NEW COMPOUNDS MEDIVIR AB (SE) 2008-09-12 WO disclosed
WO-2008107365-A1 NEW COMPOUNDS MEDIVIR AB (SE) 2008-09-12 WO disclosed