SCHEMBL3908560

SCHEMBL3908560

O=C=NC1CCCC(N=C=S)C1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.54
APLNR P35414 1/20 0.48
EPHX1 P07099 1/20 0.31
HIF1A Q16665 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
SCHEMBL3908099 0.89 APLNR (0.60) ALDH1A1APLNREPHX1HIF1A
SCHEMBL33061 0.89 ALDH1A1 (0.67) ALDH1A1EPHX1HIF1A
SCHEMBL8619404 0.89 ALDH1A1 (0.67) ALDH1A1EPHX1HIF1A
SCHEMBL2584848 0.89 ALDH1A1 (0.67) ALDH1A1EPHX1HIF1A
SCHEMBL3908196 0.86 APLNR (0.50) ALDH1A1APLNR
SCHEMBL15010774 0.86 ALDH1A1 (0.64) ALDH1A1EPHX1HIF1A
SCHEMBL19808067 0.84 ALDH1A1 (0.68) ALDH1A1APLNREPHX1HIF1A
SCHEMBL8618390 0.84 ALDH1A1 (0.75) ALDH1A1EPHX1HIF1A
SCHEMBL5970458 0.81 ALDH1A1 (0.80) ALDH1A1EPHX1HIF1A
SCHEMBL331120 0.81 APLNR (0.74) ALDH1A1APLNREPHX1HIF1A

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