SCHEMBL11399845

SCHEMBL11399845

CCCCNCCN(C)n1cc(-c2ccccc2)c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DNM2 P50570 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ SLC6A2 P23975 2/20 0.34

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
SCHEMBL11452382 0.79 L3MBTL1 (0.40) KDM4EL3MBTL1
Binedaline SCHEMBL49440 0.79 L3MBTL1 (0.42) L3MBTL1MEN1KMT2A
Binedaline SCHEMBL29393236 0.79 L3MBTL1 (0.42) L3MBTL1MEN1KMT2A
SCHEMBL11452293 0.78 L3MBTL1 (0.39) L3MBTL1POLBSLC6A2
Binedaline SCHEMBL5957158 0.78 L3MBTL1 (0.41) L3MBTL1
SCHEMBL11464649 0.72 HTR6 (0.46) KDM4EALDH1A1SMN1; SMN2L3MBTL1
Biphenyl SCHEMBL5716264 0.68 DRD2 (0.58) KDM4EALDH1A1SMN1; SMN2SIGMAR1
Biphenyl SCHEMBL7742046 0.68 SIGMAR1 (0.59) KDM4EALDH1A1SMN1; SMN2SIGMAR1
SCHEMBL11465337 0.66 RXRA (0.41) KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL11452275 0.65 MAT2A (0.50) KDM4ESMN1; SMN2POLBMEN1KMT2A

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
EP-0042054-A1 1-Amino-3-phenyl indoles, their salts and medicaments containing them SIEGFRIED AKTIENGESELLSCHAFT (CH) 1981-12-23 — — EP disclosed
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