SCHEMBL9925979

SCHEMBL9925979

COC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NCl

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA2 P00918 1/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GAA P10253 1/20 0.44
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
MMP1 P03956 1/20 0.43
MMP3 P08254 1/20 0.43
SSTR3 P32745 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
SCHEMBL10086332 1.00 LMNA (0.50) LMNAMEN1KMT2ACA2NPC1
SCHEMBL13398403 0.88 MEN1 (0.47) LMNAMEN1KMT2ACA2NPC1
SCHEMBL27549589 0.88 MEN1 (0.47) LMNAMEN1KMT2ACA2NPC1
SCHEMBL16316818 0.86 MEN1 (0.48) LMNAMEN1KMT2ACA2NPC1
SCHEMBL6139152 0.86 MEN1 (0.48) LMNAMEN1KMT2ACA2NPC1
SCHEMBL11205081 0.86 MEN1 (0.48) LMNAMEN1KMT2ACA2NPC1
SCHEMBL28774121 0.85 ITGA4 (0.47) LMNAMEN1KMT2ACA2RAB9A
SCHEMBL28774123 0.85 ITGA4 (0.47) LMNAMEN1KMT2ACA2RAB9A
SCHEMBL6575563 0.85 ALDH1A1 (0.46) LMNAMEN1KMT2ACA2NPC1
SCHEMBL22338701 0.83 MEN1 (0.49) MEN1KMT2A

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-9040626-B2 Nanofibers and morphology shifting micelles THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-05-26 US disclosed
US-20120149843-A1 NANOFIBERS AND MORPHOLOGY SHIFTING MICELLES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-06-14 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-20120149843-A1 NANOFIBERS AND MORPHOLOGY SHIFTING MICELLES MFAP1, LGALS4, TLN1 LMNA 62/4885MEN1 412/4885KMT2A 2800/4885

“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.