SCHEMBL30195616

SCHEMBL30195616

O=C(O)CCCC(Br)(Br)CCCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
SLC22A6 Q4U2R8 2/20 0.53
TSHR P16473 5/20 0.50
NFKB1 P19838 2/20 0.50
PMP22 Q01453 1/20 0.50
CAMK2A Q9UQM7 1/20 0.46
HDAC11 Q96DB2 4/20 0.43
KMT2A Q03164 2/20 0.43
GABRR3 A8MPY1 1/20 0.43
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
HDAC3 O15379 1/20 0.43
GABBR2 O75899 1/20 0.43
CYP1A2 P05177 1/20 0.43
THRB P10828 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRR1 P24046 1/20 0.43
GABRB3 P28472 1/20 0.43

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
SCHEMBL25228290 0.83 LMNA (0.53) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL10616006 0.79 LMNA (0.48) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL4812713 0.79 LMNA (0.48) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL8352290 0.78 LMNA (0.53) LMNASLC22A6TSHRNFKB1PMP22
Hydrochloric Acid SCHEMBL6708458 0.77 LMNA (0.46) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL25225114 0.76 LMNA (0.58) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL6160029 0.75 AKR1B1 (0.46) LMNASLC22A6TSHRNFKB1PMP22
Adipic Acid SCHEMBL4369555 0.75 LMNA (0.92) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL2784985 0.74 LMNA (0.56) LMNASLC22A6TSHRNFKB1PMP22
SCHEMBL25217158 0.72 LMNA (0.53) LMNASLC22A6TSHRNFKB1PMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111793004-B Bromine-containing compound and preparation method and application thereof 苏州塔霍新材料科技有限公司 2023-03-21 CN disclosed