SCHEMBL24926282

SCHEMBL24926282

CC(C)(C)NC(=O)CN1CCCCCCC1

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
CACNA1H O95180 1/20 0.54
TDP1 Q9NUW8 2/20 0.49
KMT2A Q03164 3/20 0.48
POLB P06746 2/20 0.46
MEN1 O00255 2/20 0.46
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
CACNA1I Q9P0X4 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.43
SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL24926262 1.00 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2CACNA1HTDP1KMT2A
SCHEMBL12454178 1.00 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2CACNA1HTDP1KMT2A
SCHEMBL10101745 0.98 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2CACNA1HTDP1KMT2A
SCHEMBL18743780 0.94 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2CACNA1HTDP1KMT2A
SCHEMBL26021892 0.87 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2CACNA1HTDP1KMT2A
SCHEMBL13975161 0.83 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2CACNA1HTDP1KMT2A
SCHEMBL24926263 0.83 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2CACNA1HTDP1KMT2A
SCHEMBL8248140 0.82 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2CACNA1HKMT2APOLB
SCHEMBL11930700 0.82 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2CACNA1HKMT2AMEN1
SCHEMBL22403854 0.82 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2CACNA1HKMT2AMEN1

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 ALDH1A1 3787/4885SMN1; SMN2 2381/4885CACNA1H 2070/4885

“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.