SCHEMBL11454352

SCHEMBL11454352

Cc1ccc2c(c1)c(-c1ccccc1)cn2N(C)CCN(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CSF1R P07333 1/20 0.37
▸ HTR7 P34969 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ PSMB5 P28074 1/20 0.35
▸ NLRP3 Q96P20 1/20 0.35
▸ HTR6 P50406 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL11461068 0.91 CSF1R (0.39) MAT2AL3MBTL1CSF1RHTR7CYP1A2
Binedaline SCHEMBL29393236 0.86 L3MBTL1 (0.42) L3MBTL1HTR7HTR6MEN1KMT2A
Binedaline SCHEMBL49440 0.86 L3MBTL1 (0.42) L3MBTL1HTR7HTR6MEN1KMT2A
Binedaline SCHEMBL5957158 0.85 L3MBTL1 (0.41) L3MBTL1HTR7HTR6
SCHEMBL11465337 0.80 RXRA (0.41) MAT2AHTR7HTR6KDM4EMAPT
Hydrochloric Acid SCHEMBL11452275 0.79 MAT2A (0.50) MAT2ACYP1A2CYP2D6CYP2C19HTR6
SCHEMBL11452382 0.78 L3MBTL1 (0.40) L3MBTL1HTR7HTR6KDM4E
SCHEMBL11452293 0.74 L3MBTL1 (0.39) L3MBTL1HTR6MAPT
Hydrochloric Acid SCHEMBL11461487 0.74 MAT2A (0.40) MAT2AHTR7CYP1A2CYP2D6HTR6
Hydrochloric Acid SCHEMBL11462636 0.73 L3MBTL1 (0.39) L3MBTL1HTR6MAPT

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
US-4204998-A N-Amino indole derivatives having pharmacological activity SIEGFRIED AKTIENGESELLSCHAFT (CH) 1980-05-27 — — US disclosed
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