SCHEMBL11812239

SCHEMBL11812239

O=C1C=CCCC1C=CC1CC=CCC1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 1/20 0.41
MAPT P10636 2/20 0.33
HSP90AA1 P07900 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 3/20 0.32
KDM4E B2RXH2 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
SCHEMBL11812235 1.00 ALDH1A1 (0.41) ALDH1A1ALOX15MAPTHSP90AA1SMN1; SMN2
SCHEMBL10540928 0.77 ALDH1A1 (0.64) ALDH1A1ALOX15MAPTHSP90AA1SMN1; SMN2
SCHEMBL10537870 0.77 ALDH1A1 (0.64) ALDH1A1ALOX15MAPTHSP90AA1SMN1; SMN2
SCHEMBL11801399 0.76 ALDH1A1 (0.36) ALDH1A1ALOX15GAA
SCHEMBL11801404 0.76 ALDH1A1 (0.36) ALDH1A1ALOX15GAA
SCHEMBL11799708 0.74 ALDH1A1 (0.42) ALDH1A1ALOX15MAPTHSP90AA1SMN1; SMN2
SCHEMBL11799706 0.74 ALDH1A1 (0.42) ALDH1A1ALOX15MAPTHSP90AA1SMN1; SMN2
SCHEMBL11802415 0.69 ALDH1A1 (0.38) ALDH1A1ALOX15MAPTHSP90AA1SMN1; SMN2
SCHEMBL11802419 0.69 ALDH1A1 (0.38) ALDH1A1ALOX15MAPTHSP90AA1SMN1; SMN2
SCHEMBL11804789 0.67 ALDH1A1 (0.52) ALDH1A1ALOX15

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-3948994-A Oxo-and hydroxy-substituted stilbenes PHILLIPS PETROLEUM COMPANY (US) 1976-04-06 US disclosed