SCHEMBL3421884

SCHEMBL3421884

CC(=O)Oc1ccc(S(OS(=O)(=O)C(F)(F)F)(c2ccccc2)c2ccc(OC(C)=O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.53
POLB P06746 2/20 0.53
PKM P14618 1/20 0.53
ELANE P08246 1/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HSP90AA1 P07900 1/20 0.45
GAA P10253 1/20 0.45
PTGS2 P35354 4/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 1/20 0.40
HSD11B1 P28845 1/20 0.39

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
SCHEMBL14674148 1.00 MAPT (0.53) MAPTPOLBPKMELANEALDH1A1
SCHEMBL3186459 0.87 MAPT (0.46) MAPTPOLBPKMELANEALDH1A1
SCHEMBL12274397 0.82 MAPT (0.56) MAPTPOLBPKMELANEALDH1A1
SCHEMBL3143634 0.82 PKM (0.47) POLBPKMALDH1A1LMNATDP1
SCHEMBL36493 0.82 PKM (0.47) POLBPKMALDH1A1LMNATDP1
SCHEMBL37033 0.81 HTR6 (0.42) MAPTALDH1A1LMNAKDM4ETDP1
SCHEMBL654817 0.80 SOS1 (0.51) LMNAKMT2A
SCHEMBL64049 0.79 HSD11B1 (0.41) LMNAMEN1KMT2AHSD11B1
SCHEMBL63999 0.79 HSD11B1 (0.41) LMNAMEN1KMT2AHSD11B1
SCHEMBL8969045 0.79 ELANE (0.51) MAPTPOLBPKMELANEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070111138-A1 Photoactive compounds MERCK PATENT GMBH (DE) 2007-05-17 US claimed
US-9146467-B2 Coating compositions MERCK PATENT GMBH (DE) 2015-09-29 US disclosed
US-20130236833-A1 COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-09-12 US disclosed
US-8455176-B2 Coating composition AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-06-04 US disclosed
US-20100119972-A1 COATING COMPOSITION MERCK PATENT GMBH (DE) 2010-05-13 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-20100119972-A1 COATING COMPOSITION S100A9, CAPG, C5 MAPT 488/4885POLB 1486/4885PKM 4371/4885

“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.