SCHEMBL7941247

SCHEMBL7941247

CCOC(=O)/C=C(\C)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
GAA P10253 1/20 0.56
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
NPC1 O15118 1/20 0.55
HSP90AA1 P07900 1/20 0.55
PKM P14618 1/20 0.55
HPGD P15428 1/20 0.55
CCR6 P51684 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
APOBEC3G Q9HC16 1/20 0.55
GLO1 Q04760 1/20 0.53
CES2 O00748 1/20 0.51
CES1 P23141 1/20 0.51
HTT P42858 3/20 0.51
ATM Q13315 1/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 2/20 0.49
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL11099790 1.00 ALDH1A1 (0.56) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL11099791 1.00 ALDH1A1 (0.56) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL6831082 0.88 KMT2A (0.56) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL7312492 0.87 GLO1 (0.54) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL8942551 0.86 ALDH1A1 (0.55) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL27490171 0.86 KMT2A (0.54) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL6656194 0.86 KMT2A (0.54) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL6656199 0.86 KMT2A (0.54) ALDH1A1GAAKMT2AMEN1NPC1
SCHEMBL16979582 0.85 ALDH1A1 (0.60) ALDH1A1KMT2AMEN1NPC1HSP90AA1
SCHEMBL16971093 0.85 ALDH1A1 (0.60) ALDH1A1KMT2AMEN1NPC1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220324835-A1 INHIBITORS OF CBL-B AND METHODS OF USE THEREOF NURIX THERAPEUTICS, INC. 2022-10-13 US disclosed
US-20110237576-A1 2-AMINOPYRIMIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVES BOTH HAVING BACE1-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2011-09-29 US disclosed
WO-2010047372-A1 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY 塩野義製薬株式会社 (JP) 2010-04-29 WO 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 (2 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-20110237576-A1 2-AMINOPYRIMIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVES BOTH HAVING BACE1-INHIBITING ACTIVITY BACE1, APP, BACE2 ALDH1A1 1101/4885GAA 613/4885KMT2A 1020/4885
US-20220324835-A1 INHIBITORS OF CBL-B AND METHODS OF USE THEREOF CBLB, CBL, CBLC ALDH1A1 4576/4885GAA 515/4885KMT2A 1276/4885

“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.