SCHEMBL25530625

SCHEMBL25530625

CCOC(=O)C1(C(C)(C)C)CN(C(C)(C)C)C1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 2/20 0.32
OPRK1 P41145 4/20 0.32
OPRM1 P35372 5/20 0.32
OPRD1 P41143 3/20 0.32
SLC22A1 O15245 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
KCNH2 Q12809 1/20 0.32
ATM Q13315 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31

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
SCHEMBL16075830 0.79 ALDH1A1 (0.39) POLBMAPTALDH1A1OPRK1OPRM1
SCHEMBL25532817 0.79 L3MBTL1 (0.34) POLBMAPTALDH1A1OPRK1OPRM1
SCHEMBL25530719 0.76 CYP1A2 (0.34) POLBMAPTALDH1A1OPRK1OPRM1
SCHEMBL11372937 0.74 SMN1; SMN2 (0.37) POLBALDH1A1OPRK1OPRM1OPRD1
SCHEMBL25530628 0.72 CRHBP (0.36) ALDH1A1ATMCRHBPCRHR2
SCHEMBL19498062 0.71 TSHR (0.41) POLBMAPTALDH1A1ATMLMNA
SCHEMBL19601333 0.69 ALDH1A1 (0.37) POLBMAPTALDH1A1OPRK1OPRM1
SCHEMBL12312663 0.69 OPRM1 (0.36) OPRK1OPRM1OPRD1SLC22A1SLC6A4
SCHEMBL19498054 0.68 TSHR (0.45) POLBMAPTALDH1A1ATMHSD17B10
SCHEMBL19498060 0.67 L3MBTL1 (0.40) POLBALDH1A1ATML3MBTL1

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-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 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-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 POLB 108/4885MAPT 4367/4885ALDH1A1 3752/4885

“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.