SCHEMBL23635384

SCHEMBL23635384

CCCCCC1CCC(c2ccc(OC(=O)C(C)(C)O)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.47
MAPT P10636 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
ESR2 Q92731 3/20 0.40
ELANE P08246 2/20 0.37
SPHK1 Q9NYA1 1/20 0.36
ESR1 P03372 1/20 0.36
CYP3A4 P08684 1/20 0.36
LSS P48449 1/20 0.36
S1PR3 Q99500 1/20 0.35

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
SCHEMBL23635393 0.87 CYP2C9 (0.47) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL20805906 0.86 CYP2C9 (0.50) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL23635428 0.85 CYP2C9 (0.43) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL8302303 0.85 CYP2C9 (0.49) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL11277138 0.84 CYP2C9 (0.44) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL4058753 0.84 KDM1A (0.46) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL4058749 0.84 KDM1A (0.46) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL10483925 0.84 CYP2C9 (0.48) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL9187472 0.84 KMT2A (0.49) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL9187465 0.84 KMT2A (0.49) CYP2C9MAPTALDH1A1LMNAMEN1

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-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 US disclosed