SCHEMBL3036934

SCHEMBL3036934

CCOC(=O)C1(SC(C)C)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALOX15 P16050 1/20 0.39
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ADORA1 P30542 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATM Q13315 2/20 0.35
HPGD P15428 1/20 0.35
EPHX2 P34913 1/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
CYP2C9 P11712 1/20 0.34
GPR119 Q8TDV5 1/20 0.34

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
SCHEMBL1282763 0.87 SMN1; SMN2 (0.43) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL2206945 0.79 SMN1; SMN2 (0.46) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL442966 0.78 SMN1; SMN2 (0.45) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL1147479 0.78 SMN1; SMN2 (0.45) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL398929 0.78 PKLR (0.42) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL1282206 0.77 SMN1; SMN2 (0.42) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL24192983 0.77 TSHR (0.39) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL30229162 0.77 TSHR (0.39) TSHRALOX15USP2SMN1; SMN2ADORA1
SCHEMBL3042049 0.77 GPR119 (0.40) TSHRALOX15USP2SMN1; SMN2HTT
SCHEMBL619446 0.77 SMN1; SMN2 (0.44) TSHRALOX15USP2SMN1; SMN2ADORA1

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-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE EPIX DELAWARE, INC. (US) 2010-08-19 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-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE CCR2, CCR1, CCR5 TSHR 1158/4885ALOX15 1072/4885USP2 3932/4885

“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.