SCHEMBL28508709

SCHEMBL28508709

COc1ccc(Cn2cnc(Cl)c2-c2c[nH]c3ccccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 1/20 0.52
▸ DRD2 P14416 1/20 0.52
▸ MDM4 O15151 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ MDM2 Q00987 1/20 0.49
▸ MEN1 O00255 6/20 0.45
▸ KMT2A Q03164 6/20 0.45
▸ PDGFRB P09619 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ PAX8 Q06710 1/20 0.42
▸ GAA P10253 2/20 0.42
▸ BCL2 P10415 1/20 0.42
▸ CDK4 P11802 1/20 0.41
▸ CDK6 Q00534 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41

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
SCHEMBL28505021 0.89 HTR1A (0.53) HTR1ADRD2MDM4TP53MDM2
SCHEMBL28495988 0.88 HTR1A (0.51) HTR1ADRD2MDM4TP53MDM2
SCHEMBL28514431 0.87 TP53 (0.52) HTR1ADRD2MDM4TP53MDM2
SCHEMBL28492793 0.87 MDM2 (0.62) DRD2MDM4TP53MDM2MEN1
SCHEMBL28503167 0.87 TP53 (0.56) HTR1ADRD2MDM4TP53MDM2
SCHEMBL28504165 0.85 MDM2 (0.52) HTR1ADRD2MDM4TP53MDM2
SCHEMBL28501197 0.85 MDM2 (0.52) MDM4TP53MDM2MEN1KMT2A
SCHEMBL28503010 0.83 IDO1 (0.43) HTR1ADRD2MDM4TP53MDM2
SCHEMBL28505089 0.82 MDM4 (0.49) HTR1ADRD2MDM4TP53MDM2
SCHEMBL28496321 0.81 PRKACA (0.49) MDM4TP53MDM2MEN1KMT2A

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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