SCHEMBL28497091

SCHEMBL28497091

FC(F)(F)c1ccc(Cn2cnc(Br)c2-c2c[nH]c3ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MDM2 Q00987 1/20 0.46
▸ CDK5 Q00535 1/20 0.43
▸ CDK5R1 Q15078 1/20 0.43
▸ HTR6 P50406 3/20 0.40
▸ HTR7 P34969 2/20 0.40
▸ HTR1A P08908 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ SIRT2 Q8IXJ6 1/20 0.38
▸ PTGS2 P35354 1/20 0.37
▸ GPR18 Q14330 1/20 0.37
▸ HTR1D P28221 1/20 0.37
▸ HTR1B P28222 1/20 0.37
▸ IDO1 P14902 1/20 0.37
▸ P2RX7 Q99572 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ IMPDH2 P12268 1/20 0.36

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
SCHEMBL28505089 0.88 MDM4 (0.49) MDM4TP53MDM2CDK5CDK5R1
SCHEMBL28503127 0.88 MDM4 (0.48) MDM4TP53MDM2HTR6HTR7
SCHEMBL28508740 0.87 TP53 (0.52) MDM4TP53MDM2HTR6HTR7
SCHEMBL28904632 0.86 MDM2 (0.60) MDM4TP53MDM2HTR6HTR7
SCHEMBL28506801 0.85 TP53 (0.48) MDM4TP53MDM2HTR6HTR7
SCHEMBL28495988 0.83 HTR1A (0.51) MDM4TP53MDM2HTR6HTR7
SCHEMBL28508702 0.80 MDM4 (0.44) MDM4TP53MDM2HTR6HTR7
SCHEMBL28499278 0.79 KDM4E (0.50) MDM4TP53MDM2HTR6HTR7
SCHEMBL28497886 0.79 LMNA (0.40) MDM4TP53MDM2HTR6HTR7
SCHEMBL28504165 0.77 MDM2 (0.52) MDM4TP53MDM2HTR6HTR7

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-112174937-B 3- (5-imidazolyl) indole compound and preparation method and application thereof 南京农业大学 2022-06-03 — — CN disclosed
CN-112174937-A 3- (5-imidazolyl) indole compound and preparation method and application thereof 南京农业大学 2021-01-05 — — CN disclosed
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