SCHEMBL9944366

SCHEMBL9944366

CC(C)OC(=O)c1ccc2cccnc2c1S(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
EGLN1 Q9GZT9 5/20 0.42
LMNA P02545 4/20 0.42
KDM4E B2RXH2 4/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPT P10636 3/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SLC40A1 Q9NP59 2/20 0.40
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
ALOX15 P16050 1/20 0.39
GLO1 Q04760 1/20 0.39
ALOX12 P18054 1/20 0.38
PARP1 P09874 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
SCHEMBL16131034 0.85 SLC40A1 (0.53) ALDH1A1EGLN1LMNAKDM4EMAPT
SCHEMBL9944361 0.79 ALDH1A1 (0.60) ALDH1A1LMNAKDM4EMAPTSMN1; SMN2
SCHEMBL9944365 0.73 LMNA (0.47) ALDH1A1EGLN1LMNAKDM4EMAPT
SCHEMBL9944379 0.71 P2RX7 (0.56) ALDH1A1LMNAKDM4EMAPTHTT
SCHEMBL9944362 0.71 KDM4E (0.48) ALDH1A1LMNAKDM4ECYP1A2CYP2C9
SCHEMBL9944372 0.70 KDM4E (0.52) ALDH1A1EGLN1LMNAKDM4EMAPT
SCHEMBL9944363 0.68 PDE4A (0.51) ALDH1A1LMNAKDM4EMAPTHTT
SCHEMBL2224364 0.68 MAPT (0.50) ALDH1A1LMNAKDM4EMAPTHTT
SCHEMBL28241780 0.68 MAPT (0.50) ALDH1A1LMNAKDM4EMAPTHTT
SCHEMBL160054 0.68 MAPT (0.50) ALDH1A1LMNAKDM4ECYP1A2CYP2C9

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-8846291-B2 Resist composition, method of forming resist pattern, and new compound TOKYO OHKA KOGYO CO. LTD. (JP) 2014-09-30 US disclosed
US-20120148955-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, AND NEW COMPOUND TOKYO OHKA KOGYO CO., LTD. (JP) 2012-06-14 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-20120148955-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, AND NEW COMPOUND C1R, SLC11A2, RER1 ALDH1A1 2007/4885EGLN1 856/4885LMNA 1036/4885

“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.