SCHEMBL24177835

SCHEMBL24177835

O=C(OCCN1CCOCC1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.70
▸ KDM4E B2RXH2 3/20 0.64
▸ ALDH1A1 P00352 2/20 0.64
▸ HPGD P15428 1/20 0.64
▸ EPHX2 P34913 6/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ GAA P10253 3/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ PKM P14618 1/20 0.53
▸ KMT2A Q03164 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MEN1 O00255 1/20 0.51

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
SCHEMBL24177836 0.86 ATM (0.71) ATMKDM4EALDH1A1HPGDEPHX2
SCHEMBL501199 0.84 ATM (0.73) ATMKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL24177773 0.84 ATM (0.77) ATMKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL12125739 0.83 ALDH1A1 (0.63) ALDH1A1EPHX2SMN1; SMN2GAAL3MBTL1
SCHEMBL24177759 0.82 ATM (0.67) ATMKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL11201848 0.82 ATM (1.00) ATMKDM4EALDH1A1HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL7934856 0.82 ALDH1A1 (0.65) ALDH1A1EPHX2L3MBTL1KMT2ALMNA
SCHEMBL11081554 0.81 ATM (0.97) ATMKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL8489898 0.81 ATM (0.77) ATMKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5925536 0.81 ATM (0.77) ATMKDM4EALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230152692-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 — — US disclosed
US-20220004101-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-01-06 — — US disclosed
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