SCHEMBL28435263

SCHEMBL28435263

Cc1c[nH]c2ccc(C3=CCN(C(=O)O)CC3)cc12

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.50
▸ LMNA P02545 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HTR1D P28221 12/20 0.48
▸ HTR1B P28222 12/20 0.48
▸ QDPR P09417 1/20 0.46
▸ HPGD P15428 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL21967952 0.86 HTR1D (0.55) MAPTLMNAMEN1KMT2AHTR1D
SCHEMBL20557557 0.85 MEN1 (0.47) MAPTLMNAMEN1KMT2AHTR1D
SCHEMBL29555690 0.85 MEN1 (0.47) MAPTLMNAMEN1KMT2AHTR1D
SCHEMBL30552379 0.85 GABRP (0.54) MAPTLMNAMEN1KMT2AHTR1D
SCHEMBL5950691 0.85 GABRP (0.54) MAPTLMNAMEN1KMT2AHTR1D
SCHEMBL28725598 0.83 HTR1D (0.56) KMT2AHTR1DHTR1B
SCHEMBL28725580 0.82 HTR1D (0.52) MAPTLMNAMEN1KMT2AHTR1D
SCHEMBL25223587 0.81 HTR1D (0.51) MAPTLMNAMEN1KMT2AHTR1D
SCHEMBL28725616 0.81 HTR1D (0.59) HTR1DHTR1B
SCHEMBL28725694 0.79 MAPT (0.47) MAPTLMNAMEN1KMT2AHTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111448190-B Substituted indole compounds 百时美施贵宝公司 2023-09-26 — — CN disclosed
CN-109715617-B Dimethoxyphenyl-substituted indole compounds as inhibitors of TLR7, TLR8 or TLR9 百时美施贵宝公司 2022-04-19 — — CN disclosed
CN-111448190-A Substituted indole compounds 百时美施贵宝公司 2020-07-24 — — CN disclosed
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