SCHEMBL30291479

SCHEMBL30291479

OC[C@H](O)COc1cccc(N2CCOCC2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 4/20 0.49
▸ PIK3CA P42336 4/20 0.49
▸ PIK3R1 P27986 3/20 0.49
▸ PIK3CB P42338 3/20 0.49
▸ PRMT5 O14744 1/20 0.45
▸ WDR77 Q9BQA1 1/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ GAA P10253 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ CYP2C19 P33261 3/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ KMT2A Q03164 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ PKM P14618 1/20 0.38
▸ PDE10A Q9Y233 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL30291693 1.00 PIK3CD (0.49) PIK3CDPIK3CAPIK3R1PIK3CBPRMT5
SCHEMBL30291577 0.86 GAA (0.41) PIK3CDPIK3CAPIK3R1PIK3CBPRMT5
SCHEMBL30291447 0.86 GAA (0.43) PIK3CDPIK3CAPIK3CBPRMT5WDR77
SCHEMBL30291553 0.86 GAA (0.43) PIK3CDPIK3CAPIK3CBPRMT5WDR77
SCHEMBL29355937 0.81 PIK3CA (0.46) PIK3CDPIK3CAPIK3R1PIK3CBGAA
SCHEMBL6843345 0.75 GAA (0.59) PIK3CDPIK3CASMN1; SMN2GAAMAPK1
SCHEMBL16180015 0.75 L3MBTL1 (0.45) PIK3CDPIK3CAPIK3R1PIK3CBPRMT5
SCHEMBL25230198 0.75 CYP11B2 (0.60) PIK3CBPRMT5SMN1; SMN2MAPK1KDM4E
SCHEMBL13706046 0.73 CYP2C19 (0.58) PIK3CBSMN1; SMN2GAAMAPK1CYP2C19
SCHEMBL29356853 0.73 GAA (0.43) PIK3CDPIK3CAPIK3CBSMN1; SMN2GAA

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-20230081390-A1 INHIBITORS OF RAF KINASES Pierre Fabre Médicament (FR) 2023-03-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230081390-A1 INHIBITORS OF RAF KINASES BRAF, RAF1, ARAF PIK3CD 154/4885PIK3CA 61/4885PIK3R1 107/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback