SCHEMBL569239

SCHEMBL569239

O=C(O)c1cc2cc(Br)ccc2c(I)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2A Q12879 2/20 0.49
GRIN2B Q13224 2/20 0.49
GRIN2C Q14957 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
RXFP1 Q9HBX9 2/20 0.49
GRIN2D O15399 1/20 0.49
GPR35 Q9HC97 2/20 0.45
GRIN1 Q05586 1/20 0.45
AKR1C3 P42330 4/20 0.43
AKR1C2 P52895 4/20 0.43
AKR1C1 Q04828 4/20 0.43
AKR1C4 P17516 3/20 0.43
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
DHODH Q02127 1/20 0.40
POLB P06746 1/20 0.40
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
PIM1 P11309 1/20 0.38

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
SCHEMBL30382494 0.83 GRIN2A (0.68) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL569949 0.83 GRIN2A (0.68) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL9250480 0.83 GRIN2D (0.44) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL9245071 0.82 GRIN2A (0.66) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL1223580 0.81 KDM4E (0.50) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL6351094 0.79 GPR35 (0.65) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL569862 0.78 GRIN2D (0.69) GRIN2AGRIN2BGRIN2CGRIN2DGPR35
SCHEMBL11416204 0.78 ERN1 (0.56) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL569680 0.78 POLB (0.63) GRIN2AGRIN2BGRIN2CMEN1KMT2A
SCHEMBL5029682 0.75 MEN1 (0.50) GRIN2AGRIN2BGRIN2CMEN1KMT2A

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
WO-2012019106-A2 POSITIVE AND NEGATIVE MODULATORS OF NMDA RECEPTORS BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2012-02-09 WO disclosed