SCHEMBL11849335

SCHEMBL11849335

C=CCC(=O)OC(=O)CN(CC=C)CC=C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.31
ATM Q13315 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
SCHEMBL176119 0.82 OPRK1 (0.34) MEN1KMT2AALDH1A1
SCHEMBL28061222 0.82 KDM4E (0.37) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL7032684 0.80 ALDH1A1 (0.35) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL252925 0.80 HTT (0.35) KMT2AALDH1A1
Ethylene SCHEMBL9240042 0.78 HTT (0.34) KMT2AALDH1A1
SCHEMBL1149135 0.78 ALDH1A1 (0.30) ALDH1A1
Water SCHEMBL17193173 0.78 MEN1 (0.33) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL5242147 0.77 TSHR (0.37) ALDH1A1HPGD
Acrylic Acid SCHEMBL25409274 0.76 LMNA (0.50) ALDH1A1
SCHEMBL3138082 0.75 ALDH1A1 (0.42) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1

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-3968277-A Process for coating solid particles with a digestive tract-soluble film ZENYAKU KOGYO KABUSHIKI KAISHA (JA) 1976-07-06 US claimed