SCHEMBL30516143

SCHEMBL30516143

O=C(Nc1ccc(Br)c2ccccc12)c1ccc2ccccc2c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 1.00
KMT2A Q03164 7/20 1.00
MAPT P10636 3/20 1.00
RXFP1 Q9HBX9 2/20 1.00
KDM4E B2RXH2 2/20 1.00
GAA P10253 2/20 1.00
ALDH1A1 P00352 1/20 1.00
NPSR1 Q6W5P4 1/20 1.00
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
PLG P00747 2/20 0.53
KLK1 P06870 2/20 0.53
KLK6 Q92876 2/20 0.53
P2RX1 P51575 1/20 0.51
P2RX3 P56373 1/20 0.51
P2RX4 Q99571 1/20 0.51
P2RX7 Q99572 1/20 0.51
LMNA P02545 2/20 0.50
LDHA P00338 1/20 0.50
HTT P42858 1/20 0.50

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
SCHEMBL30516144 1.00 MEN1 (1.00) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL15537171 1.00 MEN1 (1.00) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL27774119 0.84 MAPT (0.72) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL7689975 0.84 KMT2A (0.72) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL17419431 0.84 MEN1 (0.72) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL12368193 0.80 MEN1 (0.66) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL11339110 0.77 MEN1 (0.68) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL10889856 0.77 MEN1 (0.78) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL18422008 0.77 LDHA (0.65) MEN1KMT2AMAPTRXFP1KDM4E
SCHEMBL31094235 0.77 LDHA (0.65) MEN1KMT2AMAPTRXFP1KDM4E

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-116585315-A Compositions for modulating PD-1 signaling 奥古斯塔大学研究所公司 2023-08-15 CN disclosed