SCHEMBL8318923

SCHEMBL8318923

CC(C)N1c2cccc3cccc(c23)NC1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 18/20 0.41
▸ GAA P10253 10/20 0.40
▸ ALDH1A1 P00352 7/20 0.40
▸ KDM4E B2RXH2 6/20 0.40
▸ HPGD P15428 5/20 0.40
▸ ALOX12 P18054 4/20 0.40
▸ MEN1 O00255 17/20 0.39
▸ MAPT P10636 6/20 0.39
▸ THRB P10828 2/20 0.39
▸ NPC1 O15118 6/20 0.38
▸ HPN P05981 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ ALOX15 P16050 3/20 0.35
▸ POLB P06746 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ AR P10275 1/20 0.35
▸ IDE P14735 1/20 0.35
▸ USP2 O75604 1/20 0.35

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
SCHEMBL8317948 0.78 GAA (0.56) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL17916662 0.75 ALDH1A1 (0.57) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL10607517 0.74 KMT2A (0.36) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL13012832 0.68 KMT2A (0.44) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL16504030 0.67 GAA (0.50) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL10078299 0.67 MEN1 (0.55) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL19262253 0.66 MEN1 (0.50) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL10606300 0.62 GAA (0.45) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL28489824 0.62 KMT2A (0.55) KMT2AGAAALDH1A1KDM4EHPGD
SCHEMBL13807152 0.62 PTPN1 (0.38) KMT2AGAAMEN1MAPTALOX15

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0932603-A1 METHOD FOR PRODUCING 1,8-DIAMINONAPHTHALINES AND THEIR 2,3-DIHYDROPERIMIDINE DERIVATIVES BAYER AG (DE) 1999-08-04 — — EP disclosed
WO-1998015533-A1 METHOD FOR PRODUCING 1,8-DIAMINONAPHTHALINES AND THEIR 2,3-DIHYDROPERIMIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1998-04-16 — — WO disclosed
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