SCHEMBL9679245

SCHEMBL9679245

CC(=CCO)c1ncc[nH]1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 1/20 0.33
FDPS P14324 1/20 0.32

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
SCHEMBL28825040 0.79
SCHEMBL6158681 0.76
SCHEMBL6158672 0.76
SCHEMBL26157947 0.73 NPC1 (0.39) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL261956 0.73 NPC1 (0.42) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL1765877 0.72
SCHEMBL261954 0.72 NPC1 (0.41) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL17368455 0.72 NPC1 (0.45) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL261955 0.72 NPC1 (0.41) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL7695257 0.70

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
EP-0486409-A1 Method for protecting the products of multiplication of plants with the help of triazolyl/or imidazolyl-methyl allyl alcohols, and new compounds for this procedure RHONE-POULENC AGROCHIMIE (FR) 1992-05-20 EP disclosed