SCHEMBL30989243

SCHEMBL30989243

CCOC(=O)c1ccnc2[nH]nc(I)c12

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.54
TSHR P16473 1/20 0.41
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.40
TP53 P04637 1/20 0.40
KDM4E B2RXH2 3/20 0.40
LMNA P02545 1/20 0.40
JMJD6 Q6NYC1 1/20 0.40
JAK2 O60674 4/20 0.39
JAK3 P52333 4/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE4D Q08499 1/20 0.38
NPC1 O15118 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
SCHEMBL25233792 1.00 NUDT1 (0.54) NUDT1TSHRKMT2AALDH1A1MEN1
SCHEMBL30989273 0.86 KDM4E (0.43) NUDT1TSHRALDH1A1KDM4ELMNA
SCHEMBL25211367 0.86 KDM4E (0.43) NUDT1TSHRALDH1A1KDM4ELMNA
SCHEMBL30989297 0.84 NUDT1 (0.54) NUDT1TSHRKMT2AALDH1A1MEN1
SCHEMBL25222245 0.84 NUDT1 (0.54) NUDT1TSHRKMT2AALDH1A1MEN1
SCHEMBL25242164 0.82 NUDT1 (0.52) NUDT1TSHRKMT2AALDH1A1MEN1
SCHEMBL30424316 0.82 NUDT1 (0.52) NUDT1TSHRKMT2AALDH1A1MEN1
SCHEMBL29266900 0.78 KDM4E (0.39) TSHRKMT2AALDH1A1MEN1KDM4E
SCHEMBL14759956 0.76 ALDH1A1 (0.41) KMT2AALDH1A1MEN1KDM4ELMNA
SCHEMBL29904835 0.76 ALDH1A1 (0.41) KMT2AALDH1A1MEN1KDM4ELMNA

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-118302411-A Therapeutic indazole compounds and methods of use thereof for the treatment of cancer 基因泰克公司 2024-07-05 CN disclosed