SCHEMBL10071227

SCHEMBL10071227

Cc1ccc(C2CC2(C)[N+](=O)[O-])cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 5/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FBP1 P09467 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
CYP2C19 P33261 2/20 0.33
TSHR P16473 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 1/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.33
PKM P14618 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL10071235 0.84 KDM1A (0.42) HSD17B10MEN1KMT2ACYP2C19TSHR
SCHEMBL10071236 0.84 MEN1 (0.47) ALDH1A1FBP1MEN1KMT2ACYP2C19
SCHEMBL10071237 0.84 NPSR1 (0.46) FBP1MEN1KMT2ACYP2C19RECQL
SCHEMBL10071225 0.84 KDM1A (0.50) ALDH1A1MEN1KMT2ACYP2C19LMNA
SCHEMBL10071234 0.81 HSD11B1 (0.38) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL10071228 0.80 KMT2A (0.50) ACHEALDH1A1FBP1MEN1KMT2A
SCHEMBL10071239 0.75 LMNA (0.51) ACHEALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL20707753 0.72 MAOB (0.45) ACHEALDH1A1MEN1KMT2ACYP2C19
SCHEMBL25764630 0.69 MAOB (0.39) ACHEALDH1A1MEN1KMT2ACYP2C19
SCHEMBL28134241 0.68 ACHE (0.44) ACHEHSD17B10ALDH1A1SMN1; SMN2FBP1

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-8110699-B2 Cobalt-catalyzed asymmetric cyclopropanation of alkenes with α-nitrodiazoacetates UNIVERSITY OF SOUTH FLORIDA (US) 2012-02-07 US disclosed
US-20100081838-A1 Cobalt-Catalyzed Asymmetric Cyclopropanation of Alkenes with alpha-Nitrodiazoacetates UNIVERSITY OF SOUTH FLORIDA (US) 2010-04-01 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-20100081838-A1 Cobalt-Catalyzed Asymmetric Cyclopropanation of Alkenes with alpha-Nitrodiazoacetates PPOX, IDH3A, HMOX2 ACHE 1206/4885HSD17B10 392/4885ALDH1A1 665/4885

“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.