SCHEMBL889067

SCHEMBL889067

CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc3cc(Br)ccc3c2)C1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.60
PTPN1 P18031 1/20 0.60
PTPN6 P29350 1/20 0.60
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
ABL1 P00519 2/20 0.56
RIN1 Q13671 1/20 0.56
USP30 Q70CQ3 1/20 0.52
FPR2 P25090 9/20 0.51
FPR3 P25089 5/20 0.51
PARP1 P09874 1/20 0.46
PARP2 Q9UGN5 1/20 0.46
EPHX2 P34913 2/20 0.46
ALDH1A1 P00352 2/20 0.45

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
SCHEMBL12824386 0.90 USP30 (0.50) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL12771496 0.89 PTPN2 (0.72) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL18642102 0.87 PTPN2 (0.60) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL889064 0.87 PTPN2 (0.60) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL889068 0.85 USP30 (0.49) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL28497080 0.84 ABL1 (0.61) PTPN2PTPN1PTPN6ABL1USP30
SCHEMBL17643954 0.84 ABL1 (0.61) PTPN2PTPN1PTPN6ABL1USP30
SCHEMBL29200534 0.84 PTPN2 (0.70) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL2378725 0.83 PTPN2 (0.81) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL889057 0.83 ABL1 (0.63) PTPN2PTPN1PTPN6NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822700-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-09-02 US disclosed
US-8822700-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-09-02 US disclosed
US-8815928-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-08-26 US disclosed
US-8815928-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-08-26 US disclosed
US-8759332-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-06-24 US disclosed
US-8703938-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-04-22 US disclosed
US-8703938-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-04-22 US disclosed
US-20110070197-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-24 US disclosed
US-20110070197-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-24 US disclosed
US-20110064695-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064695-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064696-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064696-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064697-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 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 (4 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-20110064697-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 PTPN2 1525/4885PTPN1 1373/4885PTPN6 1659/4885
US-20110064695-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 PTPN2 1525/4885PTPN1 1373/4885PTPN6 1659/4885
US-20110064696-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 PTPN2 1525/4885PTPN1 1373/4885PTPN6 1659/4885
US-20110070197-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 PTPN2 1525/4885PTPN1 1373/4885PTPN6 1659/4885

“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.