SCHEMBL13864641

SCHEMBL13864641

COc1cc2c(cc1OC)N(CCCS(=O)(=O)O)/C(=C/c1sc3ccc4ccccc4c3[n+]1CCCS(=O)(=O)O)S2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.35
▸ KMT2A Q03164 7/20 0.35
▸ POLB P06746 6/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ BLM P54132 3/20 0.35
▸ PKM P14618 3/20 0.35
▸ HTT P42858 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ OPRK1 P41145 2/20 0.35
▸ MAPT P10636 6/20 0.34
▸ TDP1 Q9NUW8 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ CYP2C9 P11712 2/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ PRMT1 Q99873 4/20 0.34
▸ LMNA P02545 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ RECQL P46063 3/20 0.32

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
SCHEMBL13648514 0.90 MAPT (0.42) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL13864724 0.90 MAPT (0.42) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL13864675 0.90 HPGD (0.38) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL13864649 0.90 POLB (0.35) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL13864667 0.88 MAPT (0.42) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL13864741 0.88 MAPT (0.42) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL13864665 0.88 POLB (0.36) MEN1KMT2APOLBALDH1A1PKM
SCHEMBL13864647 0.88 MEN1 (0.41) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL13864725 0.87 MAPT (0.42) MEN1KMT2APOLBALDH1A1BLM
SCHEMBL5694897 0.86 MAPT (0.41) MEN1KMT2APOLBALDH1A1PKM

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-7531298-B2 Silver halide color photosensitive material FUJIFILM CORPORATION (JP) 2009-05-12 — — US disclosed
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