SCHEMBL29524985

SCHEMBL29524985

CC(=O)c1ccc(C=NC(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
KMT2A Q03164 3/20 0.41
NOS3 P29474 2/20 0.41
NOS1 P29475 2/20 0.41
MAPT P10636 6/20 0.41
HPGD P15428 3/20 0.41
RAB9A P51151 3/20 0.41
LMNA P02545 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 2/20 0.40
MAPK1 P28482 1/20 0.40
STAT3 P40763 1/20 0.40
STAT1 P42224 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ESRRG P62508 4/20 0.40
HSD17B1 P14061 1/20 0.39
MEN1 O00255 1/20 0.39
MITF O75030 1/20 0.39

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
SCHEMBL22100077 0.85 KMT2A (0.60) CA1CA2KMT2AMAPTHPGD
SCHEMBL24471647 0.85 KMT2A (0.42) CA1CA2KMT2AMAPTHPGD
SCHEMBL13955240 0.82 KMT2A (0.45) KMT2ANOS3NOS1MAPTHPGD
SCHEMBL13955334 0.77 HPGD (0.54) KMT2ANOS3NOS1MAPTHPGD
SCHEMBL22013171 0.76 CA1 (0.53) CA1CA2KMT2ANOS3NOS1
SCHEMBL29525504 0.76 CA1 (0.53) CA1CA2KMT2ANOS3NOS1
SCHEMBL21137793 0.75 ALDH1A1 (0.56) KMT2AMAPTHPGDRAB9ALMNA
SCHEMBL2498833 0.75 ALDH1A1 (0.56) KMT2AMAPTHPGDRAB9ALMNA
SCHEMBL25896990 0.74 CA1 (0.37) CA1CA2KMT2ANOS3NOS1
SCHEMBL26045346 0.74 CA1 (0.37) CA1CA2KMT2ANOS3NOS1

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-20220098155-A1 NOVEL PATHWAY FOR THE SYNTHESIS OF DIAZIRINES, THAT MAY OR MAY NOT BE ENRICHED IN NITROGEN-15 INSTITUT NATIONAL DES SCIENCES APPLIQUEES DE ROUEN (INSA) (FR) 2022-03-31 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-20220098155-A1 NOVEL PATHWAY FOR THE SYNTHESIS OF DIAZIRINES, THAT MAY OR MAY NOT BE ENRICHED IN NITROGEN-15 SSTR5, SLC6A15, SLC1A5 CA1 2258/4885CA2 1042/4885KMT2A 2417/4885

“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.