SCHEMBL8401776

SCHEMBL8401776

O=C(Nc1ccc(Br)cc1)c1ccccc1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.74
MEN1 O00255 5/20 0.73
KMT2A Q03164 5/20 0.73
TP53 P04637 3/20 0.73
HTT P42858 3/20 0.73
KDM4E B2RXH2 3/20 0.73
HSD17B10 Q99714 2/20 0.73
HPGD P15428 1/20 0.73
NPC1 O15118 5/20 0.72
RAB9A P51151 5/20 0.72
SMN1; SMN2 Q16637 2/20 0.70
POLB P06746 2/20 0.70
NFKB1 P19838 1/20 0.70
NFKB2 Q00653 1/20 0.70
RELA Q04206 1/20 0.70
P2RX1 P51575 1/20 0.69
PNLIP P16233 2/20 0.64
MAPT P10636 1/20 0.64
ALOX15 P16050 3/20 0.62
PLAU P00749 2/20 0.62

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
SCHEMBL18327174 0.91 LMNA (0.89) LMNAMEN1KMT2ATP53HTT
Osalmid SCHEMBL220088 0.85 LMNA (1.00) LMNAMEN1KMT2ATP53HTT
Osalmid SCHEMBL29928981 0.85 LMNA (1.00) LMNAMEN1KMT2ATP53HTT
Salicylanilide SCHEMBL152221 0.85 MEN1 (1.00) LMNAMEN1KMT2ATP53HTT
Salicylanilide SCHEMBL28262329 0.85 MEN1 (1.00) LMNAMEN1KMT2ATP53HTT
Salicylanilide SCHEMBL14051034 0.85 MEN1 (1.00) LMNAMEN1KMT2ATP53HTT
Salicylanilide SCHEMBL20165864 0.85 MEN1 (1.00) LMNAMEN1KMT2ATP53HTT
Tribromsalan SCHEMBL28197430 0.85 HSPD1 (0.80) LMNAMEN1KMT2ATP53HTT
Dibromsalan SCHEMBL29211119 0.83 PLAU (0.66) LMNAMEN1KMT2ATP53HTT
Salicylanilide SCHEMBL9300362 0.83 MEN1 (0.96) LMNAMEN1KMT2ATP53HTT

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
CN-109475515-A Antibacterial composition 维多利亚联结有限公司 2019-03-15 CN disclosed
CN-107635563-A Antimicrobial compound 维多利亚联结有限公司 2018-01-26 CN disclosed
US-5905090-A IMMUNOSUPPRESSANTS AND/OR ANTIINFLAMMATORIES ITALFARMACO S.P.A. (IT) 1999-05-18 US disclosed