SCHEMBL22952991

SCHEMBL22952991

COc1ccc(C(SC)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 13/20 0.60
CA4 P22748 1/20 0.50
KCNH2 Q12809 1/20 0.49
LTA4H P09960 2/20 0.48
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
TRPA1 O75762 1/20 0.44
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41

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
SCHEMBL19059423 1.00 KIF11 (0.60) KIF11CA4KCNH2LTA4HCA12
SCHEMBL23795102 0.92 CA1 (0.52) KIF11CA4LTA4HCA12CA1
SCHEMBL977257 0.86 KIF11 (0.62) KIF11CA4KCNH2LTA4HCA12
SCHEMBL2879044 0.86 KIF11 (0.62) KIF11CA4KCNH2LTA4HCA12
SCHEMBL84106 0.82 KIF11 (0.44) KIF11
SCHEMBL19514691 0.82 KIF11 (0.58) KIF11CA4KCNH2LTA4HCA12
SCHEMBL977258 0.82 KIF11 (0.58) KIF11CA4KCNH2LTA4HCA12
SCHEMBL291841 0.82 KIF11 (0.58) KIF11CA4KCNH2LTA4HCA12
SCHEMBL31396388 0.82 KIF11 (0.58) KIF11CA4KCNH2LTA4HCA12
SCHEMBL2689280 0.81 CA4 (0.56) KIF11CA4KCNH2LTA4HCA12

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
US-20210032623-A1 NUCLEIC ACID, COMPOSITION AND CONJUGATE CONTAINING NUCLEIC ACID, PREPARATION METHOD THEREFOR AND USE THEREOF Suzhou Ribo Life Science Co., Ltd. (CN) 2021-02-04 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-20210032623-A1 NUCLEIC ACID, COMPOSITION AND CONJUGATE CONTAINING NUCLEIC ACID, PREPARATION METHOD THEREFOR AND USE THEREOF TEK, IGF2BP1, METTL16 KIF11 101/4885CA4 4135/4885KCNH2 4802/4885

“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.