SCHEMBL14072677

SCHEMBL14072677

C=CC=C1C=CN(C(I)CC)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ MAPK1 P28482 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.35
▸ THRB P10828 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 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
SCHEMBL14072166 0.84 MEN1 (0.40) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL13113374 0.76 ALDH1A1 (0.54) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL18411904 0.68 MEN1 (0.51) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL19265774 0.61 — —
SCHEMBL13113852 0.59 MEN1 (0.53) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL10625407 0.58 MAPT (0.46) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL20694546 0.58 ALDH1A1 (0.51) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL10625415 0.58 MAPT (0.46) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL21453882 0.57 MAPK1 (0.34) MEN1MAPTMAPK1KMT2AL3MBTL1
SCHEMBL25634614 0.56 BRD4 (0.37) MEN1MAPTKMT2AHTTALDH1A1

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-7425221-B2 Composition comprising at least one substituted derivative of carbocyanine, method for treating keratin fibers using it, device and use L'OREAL S.A. (FR) 2008-09-16 — — US disclosed
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