SCHEMBL28294367

SCHEMBL28294367

C=C(C)C(=O)OC1CCCCC1.C=CC(=O)OC1C[C@H]2CC[C@@]1(C)C2(C)C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
CYP2C19 P33261 1/20 0.46
ELANE P08246 2/20 0.44
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
XBP1 P17861 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL23532284 1.00 KMT2A (0.46) KMT2ALMNAMEN1CYP2C19ELANE
SCHEMBL28216974 0.96 KMT2A (0.46) KMT2ALMNAMEN1CYP2C19ELANE
SCHEMBL11126961 0.91 KMT2A (0.51) KMT2ALMNAMEN1CYP2C19MAPT
SCHEMBL11126962 0.91 KMT2A (0.51) KMT2ALMNAMEN1CYP2C19MAPT
SCHEMBL6820750 0.91 KMT2A (0.51) KMT2ALMNAMEN1CYP2C19ELANE
SCHEMBL6820749 0.91 KMT2A (0.51) KMT2ALMNAMEN1CYP2C19ELANE
SCHEMBL8064810 0.91 CYP2C19 (0.51) KMT2ALMNACYP2C19ELANEMAPT
SCHEMBL28066828 0.91 KMT2A (0.51) KMT2ALMNAMEN1CYP2C19MAPT
SCHEMBL8064815 0.91 CYP2C19 (0.51) KMT2ALMNACYP2C19ELANEMAPT
SCHEMBL7897294 0.86 CYP2C19 (0.49) KMT2ALMNAMEN1CYP2C19ELANE

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
CN-103923426-B Resin combination, cured film, its forming method, semiconductor element and display element JSR株式会社 2019-06-07 CN disclosed