SCHEMBL19072199

SCHEMBL19072199

CCCCCCC1(C)c2ccccc2-c2cc3c4ccccc4n(CC)c3cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ KDM4E B2RXH2 5/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HBB P68871 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ LMNA P02545 4/20 0.40
▸ PSEN1 P49768 6/20 0.38
▸ PSEN2 P49810 6/20 0.38
▸ APH1B Q8WW43 6/20 0.38
▸ NCSTN Q92542 6/20 0.38
▸ APH1A Q96BI3 6/20 0.38
▸ PSENEN Q9NZ42 6/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 3/20 0.37

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
SCHEMBL16477985 0.87 KDM4E (0.45) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL19072011 0.84 KDM4E (0.54) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL14148344 0.81 MAPT (0.50) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL18589990 0.80 MAPT (0.52) MAPTKDM4EMEN1KMT2AMAPK1
SCHEMBL19261444 0.80 PGR (0.35) KDM4E
SCHEMBL19072010 0.80 KDM4E (0.40) MAPTKDM4EHTTHPGDLMNA
SCHEMBL6060767 0.77 PDK2 (0.40) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL14735970 0.77 PDK2 (0.40) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL6060800 0.77 PDK2 (0.40) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL6060780 0.77 PDK2 (0.40) MAPTKDM4EMEN1KMT2AALDH1A1

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-2714659-B1 COMPOUNDS WITH OXIME ESTER AND/OR ACYL GROUPS AMERICAN DYE SOURCE INC (CA) 2017-07-05 — — EP disclosed
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