SCHEMBL28205455

SCHEMBL28205455

Cc1cc(C)c(C(=O)c2ccccc2C(=O)c2ccccc2P=O)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
HPGD P15428 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
POLB P06746 1/20 0.36
AKR1C3 P42330 1/20 0.36
METAP2 P50579 1/20 0.35
ABCB1 P08183 1/20 0.34
CRHR1 P34998 1/20 0.34
MAPK13 O15264 2/20 0.33
MAPK12 P53778 2/20 0.33
MAPK11 Q15759 2/20 0.33
MAPK14 Q16539 2/20 0.33

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
SCHEMBL82365 0.97 KMT2A (0.40) ALDH1A1KMT2AMEN1HPGDNPSR1
Water SCHEMBL25255612 0.95 KMT2A (0.40) ALDH1A1KMT2AMEN1HPGDNPSR1
Ammonia Solution, Strong SCHEMBL3101939 0.95 KMT2A (0.40) ALDH1A1KMT2AMEN1HPGDNPSR1
SCHEMBL1024555 0.95 KMT2A (0.40) ALDH1A1KMT2AMEN1HPGDNPSR1
SCHEMBL1024430 0.95 KMT2A (0.40) ALDH1A1KMT2AMEN1HPGDNPSR1
SCHEMBL21831855 0.95 KMT2A (0.40) ALDH1A1KMT2AMEN1HPGDNPSR1
SCHEMBL28106357 0.87 KMT2A (0.35) ALDH1A1KMT2AMEN1HPGDNPSR1
SCHEMBL28560287 0.85 KMT2A (0.41) ALDH1A1KMT2AMEN1HPGDNPSR1
SCHEMBL28258477 0.85 KMT2A (0.47) ALDH1A1KMT2AMEN1HPGDNPSR1
SCHEMBL1830534 0.83 CYP3A4 (0.41) ALDH1A1KMT2AMEN1HPGDLMNA

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-107848274-A Cholesteric laminated resin body, Manufacturing approach and use 日本瑞翁株式会社 2018-03-27 CN disclosed