SCHEMBL5281537

SCHEMBL5281537

CCOc1ccc(C=C2SC(=S)N(C)C2=O)cc1

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.72
▸ MAPT P10636 5/20 0.70
▸ ALDH1A1 P00352 3/20 0.70
▸ LMNA P02545 2/20 0.70
▸ KDM4E B2RXH2 1/20 0.70
▸ NPSR1 Q6W5P4 1/20 0.70
▸ TDP1 Q9NUW8 1/20 0.70
▸ RAB9A P51151 2/20 0.67
▸ MITF O75030 1/20 0.67
▸ NCOA3 Q9Y6Q9 1/20 0.67
▸ CISD1 Q9NZ45 4/20 0.64
▸ MAOB P27338 3/20 0.64
▸ MEN1 O00255 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ MAOA P21397 2/20 0.63
▸ POLB P06746 1/20 0.60
▸ HPGD P15428 1/20 0.60

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
SCHEMBL5281527 1.00 MAPK1 (0.72) MAPK1MAPTALDH1A1LMNAKDM4E
SCHEMBL5281534 1.00 MAPK1 (0.72) MAPK1MAPTALDH1A1LMNAKDM4E
SCHEMBL20006042 0.85 MAPK1 (0.78) MAPK1MAPTALDH1A1LMNAKDM4E
SCHEMBL18103079 0.85 MAPK1 (0.78) MAPK1MAPTALDH1A1LMNAKDM4E
SCHEMBL18102846 0.85 MEN1 (0.67) MAPTALDH1A1RAB9AMITFNCOA3
SCHEMBL15816994 0.84 MAPK1 (1.00) MAPK1MAPTALDH1A1LMNAKDM4E
SCHEMBL15816991 0.84 MAPK1 (1.00) MAPK1MAPTALDH1A1LMNAKDM4E
SCHEMBL15816995 0.84 MAPK1 (1.00) MAPK1MAPTALDH1A1LMNAKDM4E
SCHEMBL18102932 0.84 CISD1 (0.76) MAPK1ALDH1A1KDM4ETDP1CISD1
SCHEMBL541143 0.83 MAPT (0.89) MAPTALDH1A1LMNAKDM4ECISD1

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
WO-2007002587-A2 INHIBITORS OF EPSTEIN BARR VIRUS NUCLEAR ANTIGEN 1 THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-01-04 — — WO claimed
WO-2007002587-A2 INHIBITORS OF EPSTEIN BARR VIRUS NUCLEAR ANTIGEN 1 THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-01-04 — — WO disclosed
Send feedback