SCHEMBL16449765

SCHEMBL16449765

CC(C)C1CC(=O)N(CCN2CCCCC2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.40
TERT O14746 2/20 0.38
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 1/20 0.35
POLB P06746 1/20 0.34
GAA P10253 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
SCHEMBL16449769 0.98 SIGMAR1 (0.38) SIGMAR1TERTALDH1A1TP53LMNA
SCHEMBL19601273 0.88 POLB (0.39) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL16449768 0.87 LMNA (0.36) ALDH1A1LMNASMN1; SMN2TSHRPOLB
SCHEMBL835434 0.81 CYP19A1 (0.39) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL25963873 0.81 KDM1A (0.44) SIGMAR1ALDH1A1LMNASMN1; SMN2POLB
SCHEMBL16450885 0.80 SIGMAR1 (0.42) SIGMAR1TERTALDH1A1TP53LMNA
SCHEMBL25963041 0.80 POLB (0.50) ALDH1A1TP53LMNASMN1; SMN2TSHR
SCHEMBL13318048 0.80 CYP19A1 (0.46) ALDH1A1SMN1; SMN2MEN1KMT2ATSHR
SCHEMBL16675656 0.79 MGLL (0.39) ALDH1A1TP53LMNASMN1; SMN2POLB
SCHEMBL17190592 0.79 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2POLBGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9447136-B2 Semisynthetic derivatives of Nystatin A1 BLIRT S.A. (PL) 2016-09-20 US disclosed
US-20150045316-A1 SEMISYNTHETIC DERIVATIVES OF NYSTATIN A1 BLIRT S.A. (PL) 2015-02-12 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-20150045316-A1 SEMISYNTHETIC DERIVATIVES OF NYSTATIN A1 NPC1, NPC1L1, LSS SIGMAR1 1462/4885TERT 2181/4885ALDH1A1 3940/4885

“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.