SCHEMBL10484174

SCHEMBL10484174

CC(CO)(COS(=O)(=O)CCO)NCc1cc2c3ccccc3ccc2c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 4/20 0.46
▸ HPRT1 P00492 2/20 0.31
▸ CA2 P00918 1/20 0.30
▸ MTNR1A P48039 1/20 0.30
▸ NPBWR1 P48145 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ MCHR1 Q99705 1/20 0.30

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
SCHEMBL8673861 0.89 SLC2A1 (0.50) SLC2A1HPRT1MTNR1ANPBWR1KMT2A
Crisnatol SCHEMBL10484169 0.85 SLC2A1 (0.53) SLC2A1HPRT1CA2
Crisnatol SCHEMBL3883 0.84 SLC2A1 (0.61) SLC2A1HPRT1
SCHEMBL10484175 0.82 SLC2A1 (0.44) SLC2A1HPRT1MTNR1ANPBWR1KMT2A
Crisnatol SCHEMBL6257042 0.82 SLC2A1 (0.52) SLC2A1HPRT1NPBWR1KMT2AMCHR1
Crisnatol SCHEMBL15990 0.82 SLC2A1 (0.52) SLC2A1HPRT1NPBWR1KMT2AMCHR1
Hydrochloric Acid SCHEMBL10484306 0.82 SLC2A1 (0.43) SLC2A1HPRT1NPBWR1KMT2AMCHR1
Crisnatol SCHEMBL10484286 0.81 SLC2A1 (0.51) SLC2A1HPRT1NPBWR1KMT2AMCHR1
SCHEMBL10484271 0.80 SLC2A1 (0.46) SLC2A1HPRT1NPBWR1KMT2AMCHR1
SCHEMBL10484210 0.79 SLC2A1 (0.48) SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4829090-A SECONDARY AMINES, ANTITUMOR BURROUGHS WELLCOME CO. (US) 1989-05-09 — — US disclosed
US-4810727-A ANTITUMOR BURROUGHS WELLCOME CO. (US) 1989-03-07 — — US disclosed
US-4719048-A ANTITUMOR BURROUGHS WELLCOME CO. (US) 1988-01-12 — — US disclosed
US-4719046-A ANTITUMOR BURROUGHS WELLCOME CO. (US) 1988-01-12 — — US disclosed
EP-0125702-B1 POLYCYCLIC AROMATIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1987-08-12 — — EP disclosed
EP-0125702-A2 Polycyclic aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1984-11-21 — — EP disclosed
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