SCHEMBL3908196

SCHEMBL3908196

O=C=NC1CC(N=C=S)C1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
APLNR P35414 3/20 0.50
ALDH1A1 P00352 1/20 0.44
NAAA Q02083 7/20 0.33

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
SCHEMBL3908560 0.86 ALDH1A1 (0.54) APLNRALDH1A1
SCHEMBL3909398 0.86 APLNR (0.65) APLNRNAAA
SCHEMBL49811 0.86 ALDH1A1 (0.55) ALDH1A1
SCHEMBL48591 0.86 ALDH1A1 (0.55) ALDH1A1
SCHEMBL331120 0.84 APLNR (0.74) APLNRALDH1A1
Hydrogen Sulfide SCHEMBL5133931 0.83 ALDH1A1 (0.52) ALDH1A1
SCHEMBL8622614 0.78 ALDH1A1 (0.55) APLNRALDH1A1
SCHEMBL3955252 0.78 ALDH1A1 (0.55) APLNRALDH1A1
SCHEMBL44159 0.75 ALDH1A1 (0.57) APLNRALDH1A1
SCHEMBL15010774 0.74 ALDH1A1 (0.64) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050256279-A1 Sulfur-containing composition for golf equipment, and method of using same JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-11-17 US claimed
US-7524918-B2 Sulfur-containing composition for golf equipment and method of using same ACUSHNET COMPANY (US) 2009-04-28 US disclosed
US-20060189787-A1 Sulfur-Containing Composition for Golf Equipment and Method of Using Same JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2006-08-24 US disclosed
US-7087699-B2 Sulfur-containing composition for golf equipment, and method of using same ACUSHNET COMPANY (US) 2006-08-08 US disclosed
US-20050256279-A1 Sulfur-containing composition for golf equipment, and method of using same JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-11-17 US disclosed