SCHEMBL20465367

SCHEMBL20465367

CCOC(=O)C1(CC)OC2C=CC1CC2

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 1/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ATM Q13315 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 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
SCHEMBL20468466 0.83 ATM (0.32) SLC22A1ATMMEN1KMT2APOLB
SCHEMBL38663307 0.79 SMN1; SMN2 (0.32) SLC22A1ATM
SCHEMBL24471638 0.75
SCHEMBL24471478 0.71 SMN1; SMN2 (0.37) ALDH1A1MEN1KMT2APOLB
SCHEMBL1006687 0.71 MAPT (0.32) SLC22A1ALDH1A1ATMMEN1KMT2A
SCHEMBL20465370 0.70 ATM (0.33) ALDH1A1ATMMEN1KMT2APOLB
SCHEMBL14968076 0.68 ALDH1A1 (0.34) ALDH1A1ALOX15ATMPOLB
SCHEMBL5718172 0.68 MEN1 (0.34) SLC22A1ALDH1A1ATMMEN1KMT2A
SCHEMBL6785191 0.68 MEN1 (0.34) SLC22A1ALDH1A1ATMMEN1KMT2A
SCHEMBL27131043 0.67 GAA (0.36) ALDH1A1ALOX15ATMMEN1KMT2A

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-20180221342-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-08-09 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-20180221342-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, MAVS, EIF2AK2 SLC22A1 4136/4885USP2 736/4885ALDH1A1 3966/4885

“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.