SCHEMBL8414772

SCHEMBL8414772

O=CCc1ccccc1S.[NaH]

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MDM4 O15151 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL1738495 0.98 MAPT (0.33) MAPTHDAC8ALDH1A1MDM4TP53
SCHEMBL7461135 0.80 TDP1 (0.38) ALDH1A1
SCHEMBL13035644 0.77 GABRA1 (0.41) MAPT
SCHEMBL18268986 0.77
SCHEMBL4394026 0.76 MAPT (0.31) MAPTHDAC8
SCHEMBL31201870 0.74 GABRA1 (0.47) ALDH1A1
SCHEMBL27540352 0.74 MDM4 (0.31) MDM4TP53
SCHEMBL170049 0.74 GABRA1 (0.47) ALDH1A1
SCHEMBL3119880 0.74 CYP1A2 (0.50) MAPTALDH1A1
SCHEMBL28747958 0.73 GABRA1 (0.44) MAPTHDAC8ALDH1A1MDM4TP53

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
US-5935421-A DESULFURIZE THE HEAVY OIL WITH SODIUM HYDROXIDE TO FORM SODIUM SULFIDE, STRIPPING WITH STEAM TO FORM SODIUM HYDROXIDE AND HYDROGEN SULFIDE; CONTACTING THE PARTIALLY DESULFURIZED HEAVY OIL WITH SODIUM TO PRODUCE A SULFUR-FREE PRODUCT EXXON RESEARCH AND ENGINEERING COMPANY (US) 1999-08-10 US disclosed
US-5695632-A HEATING HEAVY OIL WITH AQUEOUS SODIUM HYDROXIDE TO PARTIALLY DESULFURIZE AND FORM SODIUM SULFIDE, REGENERATING SODIUM HYDROXIDE WITH TRANSITION METAL SULFIDE, TREATING OIL WITH SODIUM METAL TO PRODUCE SULFUR-FREE OIL EXXON RESEARCH AND ENGINEERING COMPANY (US) 1997-12-09 US disclosed