SCHEMBL11577897

SCHEMBL11577897

O=C=NC(CC(=O)O)N=C=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
GABRR1 P24046 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.32
FOLH1 Q04609 1/20 0.31
MAPT P10636 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
SCHEMBL2383532 0.75
SCHEMBL9003866 0.75 TDP1 (0.40) SLC22A6TDP1SMN1; SMN2GABRR1LMNA
SCHEMBL2279444 0.75 TDP1 (0.40) SLC22A6TDP1SMN1; SMN2GABRR1LMNA
SCHEMBL8711551 0.75 TDP1 (0.40) SLC22A6TDP1SMN1; SMN2GABRR1LMNA
Water SCHEMBL28069402 0.73 TDP1 (0.39) SLC22A6TDP1SMN1; SMN2GABRR1LMNA
SCHEMBL22163809 0.72 ALDH1A1 (0.32)
SCHEMBL10336347 0.72 GSTK1 (0.45) SLC22A6GABRR1LMNATSHRFOLH1
SCHEMBL49404 0.72 SLC22A6 (0.33) SLC22A6TDP1SMN1; SMN2MAPT
SCHEMBL4186699 0.70 GSTK1 (0.48) SLC22A6LMNATSHR
SCHEMBL28811649 0.70 SLC22A6 (0.32) SLC22A6TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE29772-E IMPACT STRENGTH, CLARITY, WEATHER RESISTANCE ROHM AND HAAS COMPANY (US) 1978-09-19 US disclosed