SCHEMBL10909326

SCHEMBL10909326

Fc1cc(Cl)cc2c1NCCC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ MPI P34949 1/20 0.39
▸ PARP1 P09874 3/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HDAC4 P56524 1/20 0.33
▸ HTR2A P28223 2/20 0.33
▸ HTR2C P28335 2/20 0.33
▸ HTR2B P41595 2/20 0.33
▸ NPC1 O15118 1/20 0.31

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
SCHEMBL31159190 0.89 MEN1 (0.41) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL3713818 0.81 MEN1 (0.49) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL2361634 0.81 PARP1 (0.33) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL10912290 0.78 MEN1 (0.39) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL10909711 0.78 KDM4E (0.42) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL4941638 0.78 MEN1 (0.39) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL2333372 0.78 KDM4E (0.34) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL10912376 0.77 AR (0.40) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL30841789 0.76 PARP1 (0.33) PARP1
SCHEMBL10909321 0.74 ALDH1A1 (0.42) KDM4EMAPTMEN1KMT2AALDH1A1

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-0173208-A1 Tetrahydroquinolin-1-yl-carbonyl-imidazole derivatives NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1986-03-05 — — EP disclosed
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