SCHEMBL28344815

SCHEMBL28344815

CC(=O)C(O)c1ccc(OCCO)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ CARM1 Q86X55 1/20 0.41
▸ GAA P10253 3/20 0.39
▸ PPARG P37231 1/20 0.39
▸ PPARD Q03181 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ MTNR1A P48039 1/20 0.38
▸ MTNR1B P49286 1/20 0.38
▸ MCL1 Q07820 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ NR1I2 O75469 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL19034749 0.80 HTT (0.43) KDM4EKMT2AMEN1HTTALDH1A1
SCHEMBL586116 0.73 DRD2 (0.51) FKBP1AKDM4EGAACA12CA1
SCHEMBL5453466 0.71 GAA (0.45) GAAPPARGPPARDPPARACA12
SCHEMBL92209 0.71 NR1I2 (0.46) GAACA12CA1CA9MCL1
SCHEMBL6001702 0.70 MAPT (0.51) KDM4EGAAHTTALDH1A1NR1I2
SCHEMBL20819228 0.70 THRA (0.53) GAAPPARGPPARDPPARACA12
SCHEMBL8257779 0.69 CYP3A4 (0.45) GAAPPARGCA12CA1CA9
SCHEMBL3200851 0.69 SMN1; SMN2 (0.51) GAACA12CA1CA9KMT2A
SCHEMBL10359383 0.69 TP53 (0.66) KDM4EGAAKMT2AMEN1HTT
SCHEMBL5453470 0.69 ALDH1A1 (0.47) GAACA12CA1CA9KMT2A

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-110684135-A Itaconic acid modified photoinitiator and preparation method thereof 南昌航空大学 2020-01-14 — — CN disclosed
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