SCHEMBL10604558

SCHEMBL10604558

CC1CCCCC1N1CNc2cccc3cccc1c23

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.37
▸ GAA P10253 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ ALOX12 P18054 2/20 0.35
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL10604575 0.77 KMT2A (0.36) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL21368249 0.71 KDM4E (0.55) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL10606300 0.70 GAA (0.45) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL8972507 0.65 KMT2A (0.41) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL23870613 0.64 KMT2A (0.39) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL6934957 0.64 KMT2A (0.39) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL29091543 0.63 GAA (0.58) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL10604566 0.63 MEN1 (0.41) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL8973254 0.62 KMT2A (0.38) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL8756210 0.62 KMT2A (0.43) KMT2AGAAALDH1A1KDM4EHPGD

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
EP-0107492-B1 HELICHROMIC-SMECTIC LIQUID CRYSTAL COMPOSITIONS AND DISPLAY CELLS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-08-09 — — EP claimed
US-4514045-A DICHROISM; COMPLETE LIGHT ABSORPTION; LOW VOLTAGE; CONTRAST MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-04-30 — — US claimed
EP-0107492-A2 Helichromic-smectic liquid crystal compositions and display cells MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-05-02 — — EP claimed
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