SCHEMBL8971242

SCHEMBL8971242

C=CC(c1ccc(O)cc1)N1C(=O)C2C3C=CC(C3)C2C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 3/20 0.46
HTT P42858 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RECQL P46063 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 2/20 0.46
USP2 O75604 2/20 0.46
HSD17B10 Q99714 2/20 0.46
POLB P06746 1/20 0.46
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
THRB P10828 1/20 0.46
ALOX15 P16050 1/20 0.46
CASP1 P29466 1/20 0.46
BLM P54132 1/20 0.46
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.40
HPGD P15428 2/20 0.40

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
SCHEMBL8854361 0.86 ALDH1A1 (0.47) ALDH1A1KDM4EMEN1KMT2ARECQL
SCHEMBL8971894 0.84 MEN1 (0.40) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL8970926 0.80 ALDH1A1 (0.46) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL8971337 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL8971554 0.77 KMT2A (0.46) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL8971321 0.75 ALDH1A1 (0.35) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL8971286 0.74 ALDH1A1 (0.45) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL8854422 0.71 MEN1 (0.55) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL8970959 0.71 KMT2A (0.51) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL12599337 0.69 USP2 (0.65) ALDH1A1KDM4EHTTMEN1KMT2A

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-5521260-A ALKENYLNADIMIDE, VINYL COMPOUND, PHENOLIC RESIN MARUZEN PETROCHEMICAL CO., LTD. (JP) 1996-05-28 US disclosed
US-4579916-A IMPROVED STORAGE STABILITY CIBA-GEIGY CORPORATION (US) 1986-04-01 US disclosed