SCHEMBL15423541

SCHEMBL15423541

CC(C)OCCN1C(=O)CC(C)(C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
HSD17B10 Q99714 2/20 0.32
TSHR P16473 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM3 P20309 1/20 0.32
OPRM1 P35372 1/20 0.30
MPO P05164 1/20 0.30
POLB P06746 1/20 0.30
PTGDR2 Q9Y5Y4 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
SCHEMBL12459489 0.74 ALDH1A1 (0.41) HSD17B10TSHROPRM1MPOPOLB
SCHEMBL8283007 0.74 CHRM2 (0.41) TSHRCHRM2CHRM3
SCHEMBL8282199 0.73 PIK3CD (0.38) TSHRCHRM2CHRM3POLB
SCHEMBL16038492 0.73 CHRM2 (0.36) TSHRCHRM2CHRM3
SCHEMBL21389276 0.73 CHRM2 (0.36) TSHRCHRM2CHRM3
SCHEMBL15423533 0.72 PLA2G7 (0.54) OPRM1MPO
SCHEMBL26684109 0.72 POLB (0.44) HSD17B10TSHROPRM1MPOPOLB
SCHEMBL10159565 0.72 HSD17B10 (0.41) USP2HSD17B10TSHROPRM1MPO
SCHEMBL15112875 0.71 POLB (0.53) TSHRPOLB
SCHEMBL14359588 0.70 HTR1A (0.36) CHRM2CHRM3

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-20170290827-A1 INHIBITORS OF HEPATITIS C VIRUS GILEAD PHARMASSET LLC 2017-10-12 US disclosed
US-9296782-B2 Inhibitors of hepatitis C virus GILEAD SCIENCES, INC. (US) 2016-03-29 US disclosed
US-20140017198-A1 INHIBITORS OF HEPATITIS C VIRUS GILEAD PHARMASSET LLC 2014-01-16 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 (2 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-20170290827-A1 INHIBITORS OF HEPATITIS C VIRUS HAVCR2, SLC10A1, GOT1 USP2 3310/4885HSD17B10 293/4885TSHR 4413/4885
US-20140017198-A1 INHIBITORS OF HEPATITIS C VIRUS HAVCR2, SLC10A1, GOT1 USP2 3310/4885HSD17B10 293/4885TSHR 4413/4885

“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.