SCHEMBL27504239

SCHEMBL27504239

C=C(C)C(=O)OC.C=C(C)C(=O)OC.C=C(C)C(=O)OCC1CO1.C=C(C)C(=O)OCCO

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.71
CYP3A4 P08684 2/20 0.40
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.38
TSHR P16473 4/20 0.37
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
MGLL Q99685 2/20 0.30
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL8837734 1.00 ALDH1A1 (0.71) ALDH1A1CYP3A4TP53THRBTSHR
SCHEMBL8837669 0.94 ALDH1A1 (0.81) ALDH1A1CYP3A4TP53THRBTSHR
SCHEMBL9244699 0.92 ALDH1A1 (0.61) ALDH1A1CYP3A4TP53THRBTSHR
SCHEMBL908314 0.91 ALDH1A1 (0.86) ALDH1A1CYP3A4TP53THRBTSHR
SCHEMBL502926 0.91 ALDH1A1 (0.86) ALDH1A1CYP3A4TP53THRBTSHR
Ethylene SCHEMBL7557452 0.90 ALDH1A1 (0.83) ALDH1A1CYP3A4TP53THRBTSHR
SCHEMBL31558736 0.89 ALDH1A1 (0.71) ALDH1A1CYP3A4TP53THRBTSHR
Methacrylic Acid SCHEMBL15689003 0.87 ALDH1A1 (0.78) ALDH1A1CYP3A4TP53THRBTSHR
SCHEMBL28285678 0.87 ALDH1A1 (0.78) ALDH1A1CYP3A4TP53THRBTSHR
SCHEMBL1032756 0.87 ALDH1A1 (0.68) ALDH1A1CYP3A4TP53THRBTSHR

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
CN-1194022-C Organic anti-reflecting coating polymer and preparation thereof HYUNDAI ELECTRONICS IND (KR) 2005-03-23 CN disclosed
CN-1300790-A Organic anti-reflecting coating polymer and preparation thereof HYUNDAI ELECTRONICS IND (KR) 2001-06-27 CN disclosed