SCHEMBL16407809

SCHEMBL16407809

CCOC(=O)C1(OC(=O)Cl)CCC(F)(F)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 2/20 0.32
OPRM1 P35372 8/20 0.31
ALDH1A1 P00352 3/20 0.31
HTT P42858 1/20 0.31
OPRD1 P41143 3/20 0.31
OPRK1 P41145 3/20 0.31
SLC22A1 O15245 1/20 0.31
SLC6A4 P31645 1/20 0.31
ADRA1A P35348 1/20 0.31
KCNH2 Q12809 1/20 0.31
TRPA1 O75762 1/20 0.31
ATM Q13315 1/20 0.30

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
SCHEMBL4979796 0.91 MEN1 (0.36) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL16369921 0.81 SMN1; SMN2 (0.33) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL15105971 0.77 SMN1; SMN2 (0.38) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL16058884 0.74 SMN1; SMN2 (0.39) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL15105973 0.74 BRD4 (0.40) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL4788923 0.74 ALDH1A1 (0.52) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL15472954 0.73 MEN1 (0.38) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL15472979 0.72 L3MBTL1 (0.37) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL15114429 0.72 SMN1; SMN2 (0.37) MEN1KMT2ASMN1; SMN2POLBOPRM1
SCHEMBL15105602 0.70 SMN1; SMN2 (0.36) MEN1KMT2ASMN1; SMN2POLBOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3019196-B1 COMBINATIONS OF HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-06-06 EP disclosed
US-9770439-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-26 US disclosed
US-9770439-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-26 US disclosed
US-20160158200-A1 Combinations of Hepatitis C Virus Inhibitors BRISTOL MYERS SQUIBB CO (US) 2016-06-09 US disclosed
US-20160158200-A1 Combinations of Hepatitis C Virus Inhibitors BRISTOL MYERS SQUIBB CO (US) 2016-06-09 US disclosed
US-20150297568-A1 Hepatitis C Virus Inhibitors BRISTOL MYERS SQUIBB CO (US) 2015-10-22 US disclosed
US-20150297568-A1 Hepatitis C Virus Inhibitors BRISTOL MYERS SQUIBB CO (US) 2015-10-22 US disclosed
US-20150023913-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2015-01-22 US disclosed
US-20150023913-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2015-01-22 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 (3 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-20150023913-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, EIF2AK2 MEN1 4834/4885KMT2A 4038/4885SMN1; SMN2 4705/4885
US-20150297568-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, EIF2AK2 MEN1 4834/4885KMT2A 4038/4885SMN1; SMN2 4705/4885
US-20160158200-A1 Combinations of Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS MEN1 4813/4885KMT2A 4192/4885SMN1; SMN2 4657/4885

“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.