SCHEMBL3032069

SCHEMBL3032069

CC1=C(C)C(=O)N(c2ccccc2C(=O)Cl)C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
ALOX15 P16050 3/20 0.41
APEX1 P27695 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HSP90AA1 P07900 1/20 0.40
PKM P14618 1/20 0.40
CCR6 P51684 1/20 0.40
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TLR9 Q9NR96 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MYC P01106 5/20 0.40
NR4A1 P22736 1/20 0.40
PARP1 P09874 1/20 0.39
PARP15 Q460N3 1/20 0.39
PARP10 Q53GL7 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 2/20 0.39
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 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
SCHEMBL8889877 0.84 MYC (0.58) ALDH1A1ALOX15APEX1HSP90AA1PKM
SCHEMBL2210131 0.84 APEX1 (0.53) ALDH1A1ALOX15APEX1SMN1; SMN2HSP90AA1
Hydrochloric Acid SCHEMBL7461209 0.82 MYC (0.56) ALDH1A1ALOX15APEX1HSP90AA1PKM
SCHEMBL3036292 0.78 ALDH1A1 (0.64) ALDH1A1ALOX15SMN1; SMN2HSP90AA1PKM
SCHEMBL11514175 0.73 ALDH1A1 (0.33) ALDH1A1PARP1PARP15PARP10
SCHEMBL11245166 0.72 MYC (0.47) ALDH1A1ALOX15APEX1TDP1MYC
SCHEMBL8122598 0.70 ALDH1A1 (0.44) ALDH1A1ALOX15
SCHEMBL142040 0.69 MGLL (0.59) ALDH1A1ALOX15SMN1; SMN2TLR9L3MBTL1
SCHEMBL11646227 0.69 APEX1 (0.56) ALDH1A1ALOX15APEX1HSP90AA1PKM
SCHEMBL9654610 0.69 APEX1 (0.53) ALDH1A1APEX1SMN1; SMN2PKMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655155-B2 Liquid crystal thermoset monomer or oligomer, thermosetting liquid crystal polymer composition comprising the same and printed circuit board using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-02-02 US disclosed
US-20090224203-A1 LIQUID CRYSTAL THERMOSET MONOMER OR OLIGOMER, THERMOSETTING LIQUID CRYSTAL POLYMER COMPOSITION COMPRISING THE SAME AND PRINTED CIRCUIT BOARD USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-09-10 US disclosed
EP-0813546-B1 PHOTOCHEMICALLY CROSS-LINKED POLYSACCHARIDE DERIVATIVES AS SUPPORTS FOR THE CHROMATOGRAPHIC SEPARATION OF ENANTIOMERS NOVARTIS AG (CH) 2002-07-17 EP disclosed
US-6011149-A ESTERIFICATION; CARBAMYLATION NOVARTIS AG (CH) 2000-01-04 US disclosed
EP-0813546-A1 PHOTOCHEMICALLY CROSS-LINKED POLYSACCHARIDE DERIVATIVES AS SUPPORTS FOR THE CHROMATOGRAPHIC SEPARATION OF ENANTIOMERS Novartis AG (CH) 1997-12-29 EP disclosed
WO-1996027615-A1 PHOTOCHEMICALLY CROSS-LINKED POLYSACCHARIDE DERIVATIVES AS SUPPORTS FOR THE CHROMATOGRAPHIC SEPARATION OF ENANTIOMERS NOVARTIS AG (CH) 1996-09-12 WO 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-20090224203-A1 LIQUID CRYSTAL THERMOSET MONOMER OR OLIGOMER, THERMOSETTING LIQUID CRYSTAL POLYMER COMPOSITION COMPRISING THE SAME AND PRINTED CIRCUIT BOARD USING THE SAME MLLT1, RCC1, CNOT1 ALDH1A1 2509/4885ALOX15 2496/4885APEX1 2057/4885

“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.