SCHEMBL30602809

SCHEMBL30602809

CNS(=O)(=O)c1ccc(I)c(C(=O)NNc2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.46
▸ MAPT P10636 6/20 0.44
▸ LMNA P02545 4/20 0.44
▸ TP53 P04637 2/20 0.44
▸ TNNI3K Q59H18 1/20 0.43
▸ TEAD1 P28347 2/20 0.41
▸ YAP1 P46937 1/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TRPV4 Q9HBA0 1/20 0.40
▸ GAA P10253 3/20 0.40
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ HTT P42858 2/20 0.38
▸ TRPV1 Q8NER1 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
SCHEMBL31202807 0.75 RXFP1 (0.55) MAPTMEN1KMT2AGAATRPV1
SCHEMBL20767220 0.73 TEAD1 (0.49) IDO1MAPTLMNATP53TNNI3K
SCHEMBL20766300 0.73 TEAD1 (0.53) IDO1MAPTLMNATP53TNNI3K
SCHEMBL30602792 0.72 LMNA (0.45) LMNAMEN1KMT2AMAPK1GAA
SCHEMBL20766837 0.71 TEAD1 (0.54) IDO1MAPTLMNATP53TNNI3K
SCHEMBL4002880 0.71 MAPT (0.68) IDO1MAPTLMNATP53MEN1
SCHEMBL2371994 0.71 ALDH1A1 (0.68) IDO1MAPTLMNATNNI3KGAA
SCHEMBL22635666 0.70 ALDH1A1 (0.58) IDO1MAPTTNNI3KTEAD1YAP1
SCHEMBL22635632 0.68 TEAD1 (0.48) IDO1MAPTLMNATP53TNNI3K
SCHEMBL4000903 0.68 MEN1 (0.63) MAPTLMNATP53TNNI3KMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119095828-A Indazole compound, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2024-12-06 — — CN disclosed
WO-2023186058-A1 INDAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF IN MEDICINE 江苏恒瑞医药股份有限公司 2023-10-05 — — WO disclosed
Send feedback