SCHEMBL11735136

SCHEMBL11735136

C=CC1=NC(C)(CO)CO1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EPHX1 P07099 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL28240857 0.83 MAPT (0.33) MAPTSMN1; SMN2
SCHEMBL3783213 0.76
SCHEMBL222789 0.76
SCHEMBL594114 0.72
SCHEMBL10404782 0.71 PRKCA (0.34)
SCHEMBL11210100 0.71 PRKCA (0.34)
SCHEMBL11210145 0.71 PRKCA (0.34)
SCHEMBL21772767 0.69 MAPT (0.30) MAPTSMN1; SMN2
SCHEMBL21772699 0.68 MAPT (0.33) MAPTSMN1; SMN2
SCHEMBL15443949 0.68 EPHX1 (0.31) EPHX1

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-4045447-A COMONOMER FOR THERMOSETTING ACRYLIC COATINGS BAYER AKTIENGESELLSCHAFT (DT) 1977-08-30 US disclosed
US-3962270-A HEATING, CYCLOBUTANE-1,2-DINITRILE, AMINOETHANOL BAYER AKTIENGESELLSCHAFT (DT) 1976-06-08 US disclosed