SCHEMBL29240262

SCHEMBL29240262

CC1(C)[C@@H]2CC[C@]1(C)[C@@H](OC(=O)c1cc(Br)cc(Br)c1)C2

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.67
MAPK1 P28482 2/20 0.67
KMT2A Q03164 2/20 0.67
MEN1 O00255 1/20 0.58
ELANE P08246 2/20 0.50
CYP19A1 P11511 2/20 0.49
CYP2C19 P33261 1/20 0.49
SHBG P04278 1/20 0.48
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
XBP1 P17861 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL30923179 1.00 MAPT (0.67) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL31540152 0.85 MAPT (0.89) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL4733155 0.84 MAPT (0.70) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL309536 0.81 MAPT (0.78) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL29022975 0.81 MAPT (0.78) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL20100940 0.81 MAPT (0.65) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL27219411 0.81 MAPT (0.77) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL27219410 0.81 MAPT (0.77) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL20100936 0.80 MAPT (0.68) MAPTMAPK1KMT2AMEN1ELANE
SCHEMBL20100924 0.80 MAPT (1.00) MAPTMAPK1KMT2AMEN1ELANE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117753230-A preparation method of borneol ester-containing conjugated microporous polymer/MXene chiral composite membrane 齐齐哈尔大学 2024-03-26 CN claimed
CN-117753230-A preparation method of borneol ester-containing conjugated microporous polymer/MXene chiral composite membrane 齐齐哈尔大学 2024-03-26 CN disclosed
CN-117753230-A preparation method of borneol ester-containing conjugated microporous polymer/MXene chiral composite membrane 齐齐哈尔大学 2024-03-26 CN disclosed