SCHEMBL24927677

SCHEMBL24927677

CC(C)(C)[C@@H]1CCCN1C1CCCCCCC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
SIGMAR1 Q99720 2/20 0.31
ALDH1A1 P00352 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 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
SCHEMBL24926328 1.00 CNR1 (0.34) CNR1CNR2SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL9891858 1.00 CNR1 (0.34) CNR1CNR2SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL24926685 1.00 CNR1 (0.34) CNR1CNR2SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL24926337 0.98 CNR1 (0.33) CNR1CNR2
SCHEMBL9891857 0.98 CNR1 (0.33) CNR1CNR2
SCHEMBL16253050 0.93 CNR2 (0.33) CNR1CNR2
SCHEMBL9891856 0.93 CNR1 (0.33) CNR1CNR2
SCHEMBL16253057 0.91 CNR1 (0.32) CNR1CNR2
SCHEMBL2689915 0.91 CNR1 (0.32) CNR1CNR2
SCHEMBL9891855 0.91

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-20230031954-A1 TETRACYCLINE COMPOUNDS AND METHODS OF TREATMENT TETRAPHASE PHARMACEUTICALS, INC. 2023-02-02 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-20230031954-A1 TETRACYCLINE COMPOUNDS AND METHODS OF TREATMENT MCL1, ABL1, MALT1 CNR1 4784/4885CNR2 4800/4885SIGMAR1 4523/4885

“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.