SCHEMBL4354758

SCHEMBL4354758

Cc1ccc(S(=O)(=O)ON2C(=O)C3C4CC(C([O])C4[O])C3C2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 6/20 0.45
KDM4E B2RXH2 5/20 0.45
HPGD P15428 2/20 0.45
PARL Q9H300 2/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 4/20 0.38
F2 P00734 3/20 0.38
CYP2D6 P10635 2/20 0.37
CYP1A2 P05177 1/20 0.37
MMP2 P08253 1/20 0.36
XBP1 P17861 1/20 0.35
HTT P42858 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL4360658 0.87 KMT2A (0.49) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL4330229 0.86 VDR (0.49) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL4827161 0.85 VDR (0.63) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL14500656 0.84 VDR (0.52) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL382669 0.84 VDR (0.52) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL4837258 0.81 VDR (0.58) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL4835774 0.80 VDR (0.56) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL12198606 0.79 VDR (0.52) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL2070882 0.76 VDR (0.52) VDRSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL5555744 0.75 VDR (0.55) VDRSMN1; SMN2LMNAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090035702-A1 PROCESS FOR PRODUCING COMPOUND HAVING ACID-LABILE GROUP KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2009-02-05 US disclosed
US-20060177763-A1 Method for producing compound having acid-labile group KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2006-08-10 US disclosed
EP-1661918-A1 METHOD FOR PRODUCING COMPOUND HAVING ACID-LABILE GROUP Kyowa Hakko Chemical Co., Ltd. (JP) 2006-05-31 EP 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-20090035702-A1 PROCESS FOR PRODUCING COMPOUND HAVING ACID-LABILE GROUP AGL, HACL2, ARL1 VDR 1931/4885SMN1; SMN2 4661/4885LMNA 1507/4885

“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.