SCHEMBL10279741

SCHEMBL10279741

O=C(CCC(=O)OCC12CC3CC(CC(C3)C1)C2)OCC(F)F

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
EPHX2 P34913 3/20 0.38
NOTUM Q6P988 1/20 0.36
LMNA P02545 1/20 0.35
BPTF Q12830 1/20 0.35
TSHR P16473 2/20 0.34
PRKCA P17252 1/20 0.34
MAPT P10636 1/20 0.33
ATM Q13315 1/20 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
SCHEMBL12019102 0.79 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL13849597 0.79 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL24361872 0.78 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL13338813 0.77 MEN1 (0.59) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL10279744 0.77 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL10280255 0.77 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL12705028 0.76 ALDH1A1 (0.57) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL11991798 0.76 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL12705310 0.76 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL17281541 0.76 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AL3MBTL1CA12

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
EP-2492747-A2 Chemically amplified negative resist composition and patterning process Shin-Etsu Chemical Co., Ltd. (JP) 2012-08-29 EP disclosed