SCHEMBL9467372

SCHEMBL9467372

CCCC[Sn](CCCC)(CCCC)c1c(OCc2ccccc2)c(=O)c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
AR P10275 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPSE Q9Y251 1/20 0.38
CETP P11597 3/20 0.38
PKM P14618 1/20 0.38
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
BCHE P06276 2/20 0.36
NPC1 O15118 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
SCHEMBL2240355 0.80 THRA (0.34) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL2213430 0.78 POLB (0.30) POLBGAA
SCHEMBL2209021 0.77
SCHEMBL8370127 0.74 LMNA (0.53) LMNAPOLBGAAALDH1A1HPGD
SCHEMBL2240305 0.73 THRA (0.34) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL31302229 0.73 MEN1 (0.39) LMNAGAAALDH1A1HTTMEN1
SCHEMBL2210620 0.73
SCHEMBL7058830 0.72 LMNA (0.50) LMNAGAAARSMN1; SMN2L3MBTL1
SCHEMBL9467491 0.72 TSHR (0.32) TSHR
SCHEMBL7534835 0.70 LMNA (0.50) LMNAPOLBGAAALDH1A1HPGD

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-5206360-A Bactericides BRISTOL-MYERS SQUIBB COMPANY (US) 1993-04-27 US disclosed
US-5169843-A Bactericides BRISTOL-MYERS SQUIBB COMPANY (US) 1992-12-08 US disclosed
EP-0484030-A2 Antibiotic C-3 cyclobutenedione substituted (1-carba)cephalosporin compounds, compositions, and methods of use thereof Bristol-Myers Squibb Company (US) 1992-05-06 EP disclosed
US-5106842-A Bactericides BRISTOL-MYERS SQUIBB CO. (US) 1992-04-21 US disclosed